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

Systemtic Name: 4-cyano-N-(2,3-dimethylphenyl)-3-methyl-5-[(4-methylphenyl)carbonylamino]thiophene-2-carboxamide Openeye Name: 4-cyano-N-(2,3-dimethylphenyl)-3-methyl-5-[(4-methylbenzoyl)amino]thiophene-2-carboxamide CAS Name: 4-cyano-N-(2,3-dimethylphenyl)-3-methyl-5-[[(4-methylphenyl)-oxomethyl]amino]-2-thiophenecarboxamide IUPAC Name: 4-cyano-N-(2,3-dimethylphenyl)-3-methyl-5-[(4-methylbenzoyl)amino]thiophene-2-carboxamide Traditional Name: 4-cyano-N-(2,3-dimethylphenyl)-3-methyl-5-(p-toluoylamino)thiophene-2-carboxamide Formula: C23H21N3O2S MolecularWeight: 403.49674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=C(C(=C(S2)C(=O)NC3=CC=CC(=C3C)C)C)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=C(C(=C(S2)C(=O)NC3=CC=CC(=C3C)C)C)C#N

InChI

InChI=1S/C23H21N3O2S/c1-13-8-10-17(11-9-13)21(27)26-23-18(12-24)16(4)20(29-23)22(28)25-19-7-5-6-14(2)15(19)3/h5-11H,1-4H3,(H,25,28)(H,26,27)