4-[[3-chloranyl-5-(cyclopentylcarbonylamino)-2-(naphthalen-2-ylsulfanylmethyl)indol-1-yl]methyl]-N-methylsulfonyl-benzamide

Systemtic Name: 4-[[3-chloranyl-5-(cyclopentylcarbonylamino)-2-(naphthalen-2-ylsulfanylmethyl)indol-1-yl]methyl]-N-methylsulfonyl-benzamide Openeye Name: 4-[[3-chloro-5-(cyclopentanecarbonylamino)-2-(2-naphthylsulfanylmethyl)indol-1-yl]methyl]-N-methylsulfonyl-benzamide CAS Name: 4-[[3-chloro-5-[[cyclopentyl(oxo)methyl]amino]-2-[(2-naphthalenylthio)methyl]-1-indolyl]methyl]-N-methylsulfonylbenzamide IUPAC Name: 4-[[3-chloro-5-(cyclopentanecarbonylamino)-2-(naphthalen-2-ylsulfanylmethyl)indol-1-yl]methyl]-N-methylsulfonylbenzamide Traditional Name: 4-[[3-chloro-5-(cyclopentanecarbonylamino)-2-[(2-naphthylthio)methyl]indol-1-yl]methyl]-N-mesyl-benzamide Formula: C34H32ClN3O4S2 MolecularWeight: 646.21858

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC(=O)C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)NC(=O)C4CCCC4)C(=C2CSC5=CC6=CC=CC=C6C=C5)Cl

Isomeric SMILES

CS(=O)(=O)NC(=O)C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)NC(=O)C4CCCC4)C(=C2CSC5=CC6=CC=CC=C6C=C5)Cl

InChI

InChI=1S/C34H32ClN3O4S2/c1-44(41,42)37-34(40)25-12-10-22(11-13-25)20-38-30-17-15-27(36-33(39)24-7-3-4-8-24)19-29(30)32(35)31(38)21-43-28-16-14-23-6-2-5-9-26(23)18-28/h2,5-6,9-19,24H,3-4,7-8,20-21H2,1H3,(H,36,39)(H,37,40)