N-[1-(3-benzamidophenyl)ethyl]-N-methyl-3-(methylsulfanylmethyl)-1-benzofuran-2-carboxamide

Systemtic Name: N-[1-(3-benzamidophenyl)ethyl]-N-methyl-3-(methylsulfanylmethyl)-1-benzofuran-2-carboxamide Openeye Name: N-[1-(3-benzamidophenyl)ethyl]-N-methyl-3-(methylsulfanylmethyl)benzofuran-2-carboxamide CAS Name: N-[1-(3-benzamidophenyl)ethyl]-N-methyl-3-[(methylthio)methyl]-2-benzofurancarboxamide IUPAC Name: N-[1-(3-benzamidophenyl)ethyl]-N-methyl-3-(methylsulfanylmethyl)-1-benzofuran-2-carboxamide Traditional Name: N-[1-(3-benzamidophenyl)ethyl]-N-methyl-3-[(methylthio)methyl]coumarilamide Formula: C27H26N2O3S MolecularWeight: 458.57194

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)NC(=O)C2=CC=CC=C2)N(C)C(=O)C3=C(C4=CC=CC=C4O3)CSC

Isomeric SMILES

CC(C1=CC(=CC=C1)NC(=O)C2=CC=CC=C2)N(C)C(=O)C3=C(C4=CC=CC=C4O3)CSC

InChI

InChI=1S/C27H26N2O3S/c1-18(20-12-9-13-21(16-20)28-26(30)19-10-5-4-6-11-19)29(2)27(31)25-23(17-33-3)22-14-7-8-15-24(22)32-25/h4-16,18H,17H2,1-3H3,(H,28,30)