N-[2-[[2-(4-methoxyphenyl)-1H-indol-3-yl]sulfanyl]ethyl]-3,4-dimethyl-benzamide

Systemtic Name: N-[2-[[2-(4-methoxyphenyl)-1H-indol-3-yl]sulfanyl]ethyl]-3,4-dimethyl-benzamide Openeye Name: N-[2-[[2-(4-methoxyphenyl)-1H-indol-3-yl]sulfanyl]ethyl]-3,4-dimethyl-benzamide CAS Name: N-[2-[[2-(4-methoxyphenyl)-1H-indol-3-yl]thio]ethyl]-3,4-dimethylbenzamide IUPAC Name: N-[2-[[2-(4-methoxyphenyl)-1H-indol-3-yl]sulfanyl]ethyl]-3,4-dimethylbenzamide Traditional Name: N-[2-[[2-(4-methoxyphenyl)-1H-indol-3-yl]thio]ethyl]-3,4-dimethyl-benzamide Formula: C26H26N2O2S MolecularWeight: 430.56184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCCSC2=C(NC3=CC=CC=C32)C4=CC=C(C=C4)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCCSC2=C(NC3=CC=CC=C32)C4=CC=C(C=C4)OC)C

InChI

InChI=1S/C26H26N2O2S/c1-17-8-9-20(16-18(17)2)26(29)27-14-15-31-25-22-6-4-5-7-23(22)28-24(25)19-10-12-21(30-3)13-11-19/h4-13,16,28H,14-15H2,1-3H3,(H,27,29)