methyl 5-[(2-chloranyl-4-methyl-phenyl)carbonylamino]-4-cyano-3-methyl-thiophene-2-carboxylate

Systemtic Name: methyl 5-[(2-chloranyl-4-methyl-phenyl)carbonylamino]-4-cyano-3-methyl-thiophene-2-carboxylate Openeye Name: methyl 5-[(2-chloro-4-methyl-benzoyl)amino]-4-cyano-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[(2-chloro-4-methylphenyl)-oxomethyl]amino]-4-cyano-3-methyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[(2-chloro-4-methylbenzoyl)amino]-4-cyano-3-methylthiophene-2-carboxylate Traditional Name: 5-[(2-chloro-4-methyl-benzoyl)amino]-4-cyano-3-methyl-thiophene-2-carboxylic acid methyl ester Formula: C16H13ClN2O3S MolecularWeight: 348.80402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)NC2=C(C(=C(S2)C(=O)OC)C)C#N)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)NC2=C(C(=C(S2)C(=O)OC)C)C#N)Cl

InChI

InChI=1S/C16H13ClN2O3S/c1-8-4-5-10(12(17)6-8)14(20)19-15-11(7-18)9(2)13(23-15)16(21)22-3/h4-6H,1-3H3,(H,19,20)