5-azanyl-4-cyano-N-(dimethylcarbamoyl)-3-(4-methylphenyl)-2,3-dihydrothiophene-2-carboxamide

Systemtic Name: 5-azanyl-4-cyano-N-(dimethylcarbamoyl)-3-(4-methylphenyl)-2,3-dihydrothiophene-2-carboxamide Openeye Name: 5-amino-4-cyano-N-(dimethylcarbamoyl)-3-(p-tolyl)-2,3-dihydrothiophene-2-carboxamide CAS Name: 5-amino-4-cyano-N-[dimethylamino(oxo)methyl]-3-(4-methylphenyl)-2,3-dihydrothiophene-2-carboxamide IUPAC Name: 5-amino-4-cyano-N-(dimethylcarbamoyl)-3-(4-methylphenyl)-2,3-dihydrothiophene-2-carboxamide Traditional Name: 5-amino-4-cyano-N-(dimethylcarbamoyl)-3-(p-tolyl)-2,3-dihydrothiophene-2-carboxamide Formula: C16H18N4O2S MolecularWeight: 330.40472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(SC(=C2C#N)N)C(=O)NC(=O)N(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2C(SC(=C2C#N)N)C(=O)NC(=O)N(C)C

InChI

InChI=1S/C16H18N4O2S/c1-9-4-6-10(7-5-9)12-11(8-17)14(18)23-13(12)15(21)19-16(22)20(2)3/h4-7,12-13H,18H2,1-3H3,(H,19,21,22)