N-[2-(3-methylphenoxy)phenyl]-3-[(phenylmethylsulfanyl)methyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[2-(3-methylphenoxy)phenyl]-3-[(phenylmethylsulfanyl)methyl]-1-benzofuran-2-carboxamide Openeye Name: 3-(benzylsulfanylmethyl)-N-[2-(3-methylphenoxy)phenyl]benzofuran-2-carboxamide CAS Name: N-[2-(3-methylphenoxy)phenyl]-3-[(phenylmethylthio)methyl]-2-benzofurancarboxamide IUPAC Name: 3-(benzylsulfanylmethyl)-N-[2-(3-methylphenoxy)phenyl]-1-benzofuran-2-carboxamide Traditional Name: 3-[(benzylthio)methyl]-N-[2-(3-methylphenoxy)phenyl]coumarilamide Formula: C30H25NO3S MolecularWeight: 479.5894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2=CC=CC=C2NC(=O)C3=C(C4=CC=CC=C4O3)CSCC5=CC=CC=C5

Isomeric SMILES

CC1=CC(=CC=C1)OC2=CC=CC=C2NC(=O)C3=C(C4=CC=CC=C4O3)CSCC5=CC=CC=C5

InChI

InChI=1S/C30H25NO3S/c1-21-10-9-13-23(18-21)33-28-17-8-6-15-26(28)31-30(32)29-25(24-14-5-7-16-27(24)34-29)20-35-19-22-11-3-2-4-12-22/h2-18H,19-20H2,1H3,(H,31,32)