3,4-dimethyl-N-[2-[3-[(2-methylphenyl)methylsulfanyl]indol-1-yl]ethyl]benzamide

Systemtic Name: 3,4-dimethyl-N-[2-[3-[(2-methylphenyl)methylsulfanyl]indol-1-yl]ethyl]benzamide Openeye Name: 3,4-dimethyl-N-[2-[3-(o-tolylmethylsulfanyl)indol-1-yl]ethyl]benzamide CAS Name: 3,4-dimethyl-N-[2-[3-[(2-methylphenyl)methylthio]-1-indolyl]ethyl]benzamide IUPAC Name: 3,4-dimethyl-N-[2-[3-[(2-methylphenyl)methylsulfanyl]indol-1-yl]ethyl]benzamide Traditional Name: 3,4-dimethyl-N-[2-[3-[(2-methylbenzyl)thio]indol-1-yl]ethyl]benzamide Formula: C27H28N2OS MolecularWeight: 428.58902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCCN2C=C(C3=CC=CC=C32)SCC4=CC=CC=C4C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCCN2C=C(C3=CC=CC=C32)SCC4=CC=CC=C4C)C

InChI

InChI=1S/C27H28N2OS/c1-19-12-13-22(16-21(19)3)27(30)28-14-15-29-17-26(24-10-6-7-11-25(24)29)31-18-23-9-5-4-8-20(23)2/h4-13,16-17H,14-15,18H2,1-3H3,(H,28,30)