3-[1-[(2-methylphenyl)methyl]indol-3-yl]-N-[2-(4-methylsulfanylphenyl)ethyl]propanamide

Systemtic Name: 3-[1-[(2-methylphenyl)methyl]indol-3-yl]-N-[2-(4-methylsulfanylphenyl)ethyl]propanamide Openeye Name: N-[2-(4-methylsulfanylphenyl)ethyl]-3-[1-(o-tolylmethyl)indol-3-yl]propanamide CAS Name: 3-[1-[(2-methylphenyl)methyl]-3-indolyl]-N-[2-[4-(methylthio)phenyl]ethyl]propanamide IUPAC Name: 3-[1-[(2-methylphenyl)methyl]indol-3-yl]-N-[2-(4-methylsulfanylphenyl)ethyl]propanamide Traditional Name: 3-[1-(2-methylbenzyl)indol-3-yl]-N-[2-[4-(methylthio)phenyl]ethyl]propionamide Formula: C28H30N2OS MolecularWeight: 442.6156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=C(C3=CC=CC=C32)CCC(=O)NCCC4=CC=C(C=C4)SC

Isomeric SMILES

CC1=CC=CC=C1CN2C=C(C3=CC=CC=C32)CCC(=O)NCCC4=CC=C(C=C4)SC

InChI

InChI=1S/C28H30N2OS/c1-21-7-3-4-8-23(21)19-30-20-24(26-9-5-6-10-27(26)30)13-16-28(31)29-18-17-22-11-14-25(32-2)15-12-22/h3-12,14-15,20H,13,16-19H2,1-2H3,(H,29,31)