Chem
J-GLOBAL ID：201407089579211734   Nikkaji number：J3.309.611I

3′-(4α-Phenyl-4-methyl-6-amidino-1,2,3,4-tetrahydroquinoline-2α-yl)-5′-[(3-methylbutyryl)amino]-4-carbamoylbiphenyl-2-carboxylic acid

3′-(4α-フェニル-4-メチル-6-アミジノ-1,2,3,4-テトラヒドロキノリン-2α-イル)-5′-[(3-メチルブチリル)アミノ]-4-カルバモイルビフェニル-2-カルボン酸
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C36H37N5O4
Molecular formula furigana： C36-H37-N5-O4
Molecular weight： 603.723
InChI： InChI=1S/C36H37N5O4/c1-20(2)13-32(42)40-26-15-23(27-11-9-22(34(39)43)17-28(27)35(44)45)14-24(16-26)31-19-36(3,25-7-5-4-6-8-25)29-18-21(33(37)38)10-12-30(29)41-31/h4-12,14-18,20,31,41H,13,19H2,1-3H3,(H3,37,38)(H2,39,43)(H,40,42)(H,44,45)/t31-,36+/m0/s1
InChI key： PDUMJXCNOKHQKH-SVXHESJVSA-N
SMILES： CC(C)CC(=O)Nc1cc(cc(c1)c1ccc(cc1C(=O)O)C(=O)N)[C@@H]1C[C@](C)(c2ccccc2)c2cc(ccc2N1)C(=N)N
Systematic name  (3)：
  • 3′-(4α-フェニル-4-メチル-6-アミジノ-1,2,3,4-テトラヒドロキノリン-2α-イル)-5′-[(3-メチルブチリル)アミノ]-4-カルバモイルビフェニル-2-カルボン酸
  • 3'-[(2S,4R)-6-カルバムイミドイル-4-メチル-4-フェニル-1,2,3,4-テトラヒドロキノリン-2-イル]-4-カルバモイル-5'-(3-メチルブタンアミド)-[1,1'-ビフェニル]-2-カルボン酸
  • 3'-[(2S,4R)-6-carbamimidoyl-4-methyl-4-phenyl-1,2,3,4-tetrahydroquinolin-2-yl]-4-carbamoyl-5'-(3-methylbutanamido)-[1,1'-biphenyl]-2-carboxylic acid
Other name (1)：
  • 3′-(4α-Phenyl-4-methyl-6-amidino-1,2,3,4-tetrahydroquinoline-2α-yl)-5′-[(3-methylbutyryl)amino]-4-carbamoylbiphenyl-2-carboxylic acid
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM