Chem
J-GLOBAL ID:200907071855093167
Nikkaji number:J737.734G
Alniditan
アルニジタン
Download MOL file
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:
C17 H26 N4 O
Molecular formula furigana:
C17-H26-N4-O
Molecular weight:
302.422
InChI:
InChI=1S/C17H26N4O/c1-2-6-16-14(5-1)7-8-15(22-16)13-18-9-3-10-19-17-20-11-4-12-21-17/h1-2,5-6,15,18H,3-4,7-13H2,(H2,19,20,21)/t15-/m1/s1
InChI key:
QVSXOXCYXPQXMF-OAHLLOKOSA-N
SMILES:
C(CNC[C@H]1CCc2ccccc2O1)CNC1=NCCCN1
Systematic name (4):
(2R)-3,4-ジヒドロ-N-[3-[[(1,4,5,6-テトラヒドロピリミジン)-2-イル]アミノ]プロピル]-2H-1-ベンゾピラン-2-メタンアミン
N-[[(R)-クロマン-2β-イル]メチル]-N′-[(1,4,5,6-テトラヒドロピリミジン)-2-イル]-1,3-プロパンジアミン
N-[3-({[(2R)-3,4-ジヒドロ-2H-1-ベンゾピラン-2-イル]メチル}アミノ)プロピル]-1,4,5,6-テトラヒドロピリミジン-2-アミン
N-[3-({[(2R)-3,4-dihydro-2H-1-benzopyran-2-yl]methyl}amino)propyl]-1,4,5,6-tetrahydropyrimidin-2-amine
Other name (5):
N-[[(R)-Chroman-2β-yl]methyl]-N′-[(1,4,5,6-tetrahydropyrimidin)-2-yl]-1,3-propanediamine
Alnitidan
アルニチダン
アルニジタン
Alniditan
CAS registry number:
152317-89-0
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