Chem
J-GLOBAL ID:200907013912043112
Nikkaji number:J741.371H
TP-680
2-[[(R)-2-(1H-インドール-2-イルカルボニルアミノ)-3-(4-ベンズヒドリルピペラジノ)-3-オキソプロピル]チオ]ニコチン酸
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:
C35 H33 N5 O4 S
Molecular formula furigana:
C35-H33-N5-O4-S
Molecular weight:
619.740
InChI:
InChI=1S/C35H33N5O4S/c41-32(29-22-26-14-7-8-16-28(26)37-29)38-30(23-45-33-27(35(43)44)15-9-17-36-33)34(42)40-20-18-39(19-21-40)31(24-10-3-1-4-11-24)25-12-5-2-6-13-25/h1-17,22,30-31,37H,18-21,23H2,(H,38,41)(H,43,44)/t30-/m0/s1
InChI key:
JWXZKQOPZVEJHR-PMERELPUSA-N
SMILES:
OC(=O)c1cccnc1SC[C@H](NC(=O)c1cc2ccccc2[nH]1)C(=O)N1CCN(CC1)C(c1ccccc1)c1ccccc1
Systematic name (3):
2-[[(R)-2-(1H-インドール-2-イルカルボニルアミノ)-3-(4-ベンズヒドリルピペラジノ)-3-オキソプロピル]チオ]ニコチン酸
2-{[(2R)-3-[4-(ジフェニルメチル)ピペラジン-1-イル]-2-[(1H-インドール-2-イル)ホルムアミド]-3-オキソプロピル]スルファニル}ピリジン-3-カルボン酸
2-{[(2R)-3-[4-(diphenylmethyl)piperazin-1-yl]-2-[(1H-indol-2-yl)formamido]-3-oxopropyl]sulfanyl}pyridine-3-carboxylic acid
Other name (2):
TP-680
2-[[(R)-2-(1H-Indol-2-ylcarbonylamino)-3-(4-benzhydrylpiperazino)-3-oxopropyl]thio]nicotinic acid
Thsaurus map:
Return to Previous Page