2-[1-(4-chlorophenyl)carbonyl-5-methoxy-2-methyl-indol-3-yl]-N-(2-sulfanylethyl)ethanamide

Systemtic Name: 2-[1-(4-chlorophenyl)carbonyl-5-methoxy-2-methyl-indol-3-yl]-N-(2-sulfanylethyl)ethanamide Openeye Name: 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-indol-3-yl]-N-(2-sulfanylethyl)acetamide CAS Name: 2-[1-[(4-chlorophenyl)-oxomethyl]-5-methoxy-2-methyl-3-indolyl]-N-(2-mercaptoethyl)acetamide IUPAC Name: 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]-N-(2-sulfanylethyl)acetamide Traditional Name: 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-indol-3-yl]-N-(2-mercaptoethyl)acetamide Formula: C21H21ClN2O3S MolecularWeight: 416.92104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)NCCS

Isomeric SMILES

CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)NCCS

InChI

InChI=1S/C21H21ClN2O3S/c1-13-17(12-20(25)23-9-10-28)18-11-16(27-2)7-8-19(18)24(13)21(26)14-3-5-15(22)6-4-14/h3-8,11,28H,9-10,12H2,1-2H3,(H,23,25)