N-(4-butylphenyl)-2-[1-[(2-chlorophenyl)methyl]indol-3-yl]sulfanyl-ethanamide

Systemtic Name: N-(4-butylphenyl)-2-[1-[(2-chlorophenyl)methyl]indol-3-yl]sulfanyl-ethanamide Openeye Name: N-(4-butylphenyl)-2-[1-[(2-chlorophenyl)methyl]indol-3-yl]sulfanyl-acetamide CAS Name: N-(4-butylphenyl)-2-[[1-[(2-chlorophenyl)methyl]-3-indolyl]thio]acetamide IUPAC Name: N-(4-butylphenyl)-2-[1-[(2-chlorophenyl)methyl]indol-3-yl]sulfanylacetamide Traditional Name: N-(4-butylphenyl)-2-[[1-(2-chlorobenzyl)indol-3-yl]thio]acetamide Formula: C27H27ClN2OS MolecularWeight: 463.03408

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)CSC2=CN(C3=CC=CC=C32)CC4=CC=CC=C4Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)CSC2=CN(C3=CC=CC=C32)CC4=CC=CC=C4Cl

InChI

InChI=1S/C27H27ClN2OS/c1-2-3-8-20-13-15-22(16-14-20)29-27(31)19-32-26-18-30(25-12-7-5-10-23(25)26)17-21-9-4-6-11-24(21)28/h4-7,9-16,18H,2-3,8,17,19H2,1H3,(H,29,31)