propan-2-yl 5-[(4-chlorophenyl)carbamoylamino]-4-cyano-3-methyl-thiophene-2-carboxylate

Systemtic Name: propan-2-yl 5-[(4-chlorophenyl)carbamoylamino]-4-cyano-3-methyl-thiophene-2-carboxylate Openeye Name: isopropyl 5-[(4-chlorophenyl)carbamoylamino]-4-cyano-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[(4-chloroanilino)-oxomethyl]amino]-4-cyano-3-methyl-2-thiophenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 5-[(4-chlorophenyl)carbamoylamino]-4-cyano-3-methylthiophene-2-carboxylate Traditional Name: 5-[(4-chlorophenyl)carbamoylamino]-4-cyano-3-methyl-thiophene-2-carboxylic acid isopropyl ester Formula: C17H16ClN3O3S MolecularWeight: 377.84524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)NC2=CC=C(C=C2)Cl)C(=O)OC(C)C

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)NC2=CC=C(C=C2)Cl)C(=O)OC(C)C

InChI

InChI=1S/C17H16ClN3O3S/c1-9(2)24-16(22)14-10(3)13(8-19)15(25-14)21-17(23)20-12-6-4-11(18)5-7-12/h4-7,9H,1-3H3,(H2,20,21,23)