N-(2,5-dimethoxyphenyl)-2-[1-(phenylmethyl)indol-3-yl]sulfanyl-ethanamide

Systemtic Name: N-(2,5-dimethoxyphenyl)-2-[1-(phenylmethyl)indol-3-yl]sulfanyl-ethanamide Openeye Name: 2-(1-benzylindol-3-yl)sulfanyl-N-(2,5-dimethoxyphenyl)acetamide CAS Name: N-(2,5-dimethoxyphenyl)-2-[[1-(phenylmethyl)-3-indolyl]thio]acetamide IUPAC Name: 2-(1-benzylindol-3-yl)sulfanyl-N-(2,5-dimethoxyphenyl)acetamide Traditional Name: 2-[(1-benzylindol-3-yl)thio]-N-(2,5-dimethoxyphenyl)acetamide Formula: C25H24N2O3S MolecularWeight: 432.53466

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC(=O)CSC2=CN(C3=CC=CC=C32)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC(=O)CSC2=CN(C3=CC=CC=C32)CC4=CC=CC=C4

InChI

InChI=1S/C25H24N2O3S/c1-29-19-12-13-23(30-2)21(14-19)26-25(28)17-31-24-16-27(15-18-8-4-3-5-9-18)22-11-7-6-10-20(22)24/h3-14,16H,15,17H2,1-2H3,(H,26,28)