N-methyl-N-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]-3-[(phenylmethylsulfanyl)methyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-methyl-N-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]-3-[(phenylmethylsulfanyl)methyl]-1-benzofuran-2-carboxamide Openeye Name: 3-(benzylsulfanylmethyl)-N-[2-(isopropylamino)-2-oxo-ethyl]-N-methyl-benzofuran-2-carboxamide CAS Name: N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-3-[(phenylmethylthio)methyl]-2-benzofurancarboxamide IUPAC Name: 3-(benzylsulfanylmethyl)-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1-benzofuran-2-carboxamide Traditional Name: 3-[(benzylthio)methyl]-N-[2-(isopropylamino)-2-keto-ethyl]-N-methyl-coumarilamide Formula: C23H26N2O3S MolecularWeight: 410.52914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CN(C)C(=O)C1=C(C2=CC=CC=C2O1)CSCC3=CC=CC=C3

Isomeric SMILES

CC(C)NC(=O)CN(C)C(=O)C1=C(C2=CC=CC=C2O1)CSCC3=CC=CC=C3

InChI

InChI=1S/C23H26N2O3S/c1-16(2)24-21(26)13-25(3)23(27)22-19(18-11-7-8-12-20(18)28-22)15-29-14-17-9-5-4-6-10-17/h4-12,16H,13-15H2,1-3H3,(H,24,26)