N-[2-(1H-indol-3-yl)ethyl]-3-[(phenylmethylsulfanyl)methyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[2-(1H-indol-3-yl)ethyl]-3-[(phenylmethylsulfanyl)methyl]-1-benzofuran-2-carboxamide Openeye Name: 3-(benzylsulfanylmethyl)-N-[2-(1H-indol-3-yl)ethyl]benzofuran-2-carboxamide CAS Name: N-[2-(1H-indol-3-yl)ethyl]-3-[(phenylmethylthio)methyl]-2-benzofurancarboxamide IUPAC Name: 3-(benzylsulfanylmethyl)-N-[2-(1H-indol-3-yl)ethyl]-1-benzofuran-2-carboxamide Traditional Name: 3-[(benzylthio)methyl]-N-[2-(1H-indol-3-yl)ethyl]coumarilamide Formula: C27H24N2O2S MolecularWeight: 440.55666

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCC2=C(OC3=CC=CC=C32)C(=O)NCCC4=CNC5=CC=CC=C54

Isomeric SMILES

C1=CC=C(C=C1)CSCC2=C(OC3=CC=CC=C32)C(=O)NCCC4=CNC5=CC=CC=C54

InChI

InChI=1S/C27H24N2O2S/c30-27(28-15-14-20-16-29-24-12-6-4-10-21(20)24)26-23(22-11-5-7-13-25(22)31-26)18-32-17-19-8-2-1-3-9-19/h1-13,16,29H,14-15,17-18H2,(H,28,30)