2-(butanoylamino)-5-methyl-4-phenyl-thiophene-3-carboxylate

Systemtic Name: 2-(butanoylamino)-5-methyl-4-phenyl-thiophene-3-carboxylate Openeye Name: 2-(butanoylamino)-5-methyl-4-phenyl-thiophene-3-carboxylate CAS Name: 5-methyl-2-(1-oxobutylamino)-4-phenyl-3-thiophenecarboxylate IUPAC Name: 2-(butanoylamino)-5-methyl-4-phenylthiophene-3-carboxylate Traditional Name: 2-butyramido-5-methyl-4-phenyl-3-thenoate Formula: C16H16NO3S- MolecularWeight: 302.36814

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=C(C(=C(S1)C)C2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

CCCC(=O)NC1=C(C(=C(S1)C)C2=CC=CC=C2)C(=O)[O-]

InChI

InChI=1S/C16H17NO3S/c1-3-7-12(18)17-15-14(16(19)20)13(10(2)21-15)11-8-5-4-6-9-11/h4-6,8-9H,3,7H2,1-2H3,(H,17,18)(H,19,20)/p-1