N-(3-chloranyl-4-methyl-phenyl)-2-[1-(phenylmethyl)indol-3-yl]sulfanyl-ethanamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-2-[1-(phenylmethyl)indol-3-yl]sulfanyl-ethanamide Openeye Name: 2-(1-benzylindol-3-yl)sulfanyl-N-(3-chloro-4-methyl-phenyl)acetamide CAS Name: N-(3-chloro-4-methylphenyl)-2-[[1-(phenylmethyl)-3-indolyl]thio]acetamide IUPAC Name: 2-(1-benzylindol-3-yl)sulfanyl-N-(3-chloro-4-methylphenyl)acetamide Traditional Name: 2-[(1-benzylindol-3-yl)thio]-N-(3-chloro-4-methyl-phenyl)acetamide Formula: C24H21ClN2OS MolecularWeight: 420.95434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC2=CN(C3=CC=CC=C32)CC4=CC=CC=C4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC2=CN(C3=CC=CC=C32)CC4=CC=CC=C4)Cl

InChI

InChI=1S/C24H21ClN2OS/c1-17-11-12-19(13-21(17)25)26-24(28)16-29-23-15-27(14-18-7-3-2-4-8-18)22-10-6-5-9-20(22)23/h2-13,15H,14,16H2,1H3,(H,26,28)