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

Systemtic Name: 5-methyl-2-(2-methylpropanoylamino)-4-phenyl-thiophene-3-carboxylate Openeye Name: 5-methyl-2-(2-methylpropanoylamino)-4-phenyl-thiophene-3-carboxylate CAS Name: 5-methyl-2-[(2-methyl-1-oxopropyl)amino]-4-phenyl-3-thiophenecarboxylate IUPAC Name: 5-methyl-2-(2-methylpropanoylamino)-4-phenylthiophene-3-carboxylate Traditional Name: 2-(isobutyrylamino)-5-methyl-4-phenyl-3-thenoate Formula: C16H16NO3S- MolecularWeight: 302.36814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)C(C)C)C(=O)[O-])C2=CC=CC=C2

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)C(C)C)C(=O)[O-])C2=CC=CC=C2

InChI

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