N-(2-azanyl-2-oxidanylidene-ethyl)-3-[(4-chlorophenyl)sulfanylmethyl]-N-propan-2-yl-1-benzofuran-2-carboxamide

Systemtic Name: N-(2-azanyl-2-oxidanylidene-ethyl)-3-[(4-chlorophenyl)sulfanylmethyl]-N-propan-2-yl-1-benzofuran-2-carboxamide Openeye Name: N-(2-amino-2-oxo-ethyl)-3-[(4-chlorophenyl)sulfanylmethyl]-N-isopropyl-benzofuran-2-carboxamide CAS Name: N-(2-amino-2-oxoethyl)-3-[[(4-chlorophenyl)thio]methyl]-N-propan-2-yl-2-benzofurancarboxamide IUPAC Name: N-(2-amino-2-oxoethyl)-3-[(4-chlorophenyl)sulfanylmethyl]-N-propan-2-yl-1-benzofuran-2-carboxamide Traditional Name: N-(2-amino-2-keto-ethyl)-3-[[(4-chlorophenyl)thio]methyl]-N-isopropyl-coumarilamide Formula: C21H21ClN2O3S MolecularWeight: 416.92104

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC(=O)N)C(=O)C1=C(C2=CC=CC=C2O1)CSC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)N(CC(=O)N)C(=O)C1=C(C2=CC=CC=C2O1)CSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H21ClN2O3S/c1-13(2)24(11-19(23)25)21(26)20-17(16-5-3-4-6-18(16)27-20)12-28-15-9-7-14(22)8-10-15/h3-10,13H,11-12H2,1-2H3,(H2,23,25)