5-[(3-chlorophenyl)carbonylamino]-4-cyano-3-methyl-N-(2-methylphenyl)thiophene-2-carboxamide

Systemtic Name: 5-[(3-chlorophenyl)carbonylamino]-4-cyano-3-methyl-N-(2-methylphenyl)thiophene-2-carboxamide Openeye Name: 5-[(3-chlorobenzoyl)amino]-4-cyano-3-methyl-N-(o-tolyl)thiophene-2-carboxamide CAS Name: 5-[[(3-chlorophenyl)-oxomethyl]amino]-4-cyano-3-methyl-N-(2-methylphenyl)-2-thiophenecarboxamide IUPAC Name: 5-[(3-chlorobenzoyl)amino]-4-cyano-3-methyl-N-(2-methylphenyl)thiophene-2-carboxamide Traditional Name: 5-[(3-chlorobenzoyl)amino]-4-cyano-3-methyl-N-(o-tolyl)thiophene-2-carboxamide Formula: C21H16ClN3O2S MolecularWeight: 409.88864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C2=C(C(=C(S2)NC(=O)C3=CC(=CC=C3)Cl)C#N)C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C2=C(C(=C(S2)NC(=O)C3=CC(=CC=C3)Cl)C#N)C

InChI

InChI=1S/C21H16ClN3O2S/c1-12-6-3-4-9-17(12)24-20(27)18-13(2)16(11-23)21(28-18)25-19(26)14-7-5-8-15(22)10-14/h3-10H,1-2H3,(H,24,27)(H,25,26)