methyl 4-methyl-3-[(4-oxidanylidene-4-thiophen-2-yl-butanoyl)amino]benzoate

Systemtic Name: methyl 4-methyl-3-[(4-oxidanylidene-4-thiophen-2-yl-butanoyl)amino]benzoate Openeye Name: methyl 4-methyl-3-[[4-oxo-4-(2-thienyl)butanoyl]amino]benzoate CAS Name: 3-[(1,4-dioxo-4-thiophen-2-ylbutyl)amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[(4-oxo-4-thiophen-2-ylbutanoyl)amino]benzoate Traditional Name: 3-[[4-keto-4-(2-thienyl)butanoyl]amino]-4-methyl-benzoic acid methyl ester Formula: C17H17NO4S MolecularWeight: 331.38618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CCC(=O)C2=CC=CS2

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CCC(=O)C2=CC=CS2

InChI

InChI=1S/C17H17NO4S/c1-11-5-6-12(17(21)22-2)10-13(11)18-16(20)8-7-14(19)15-4-3-9-23-15/h3-6,9-10H,7-8H2,1-2H3,(H,18,20)