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

Systemtic Name: 5-azanyl-4-cyano-N-(dimethylcarbamoyl)-3-(4-methoxyphenyl)-2,3-dihydrothiophene-2-carboxamide Openeye Name: 5-amino-4-cyano-N-(dimethylcarbamoyl)-3-(4-methoxyphenyl)-2,3-dihydrothiophene-2-carboxamide CAS Name: 5-amino-4-cyano-N-[dimethylamino(oxo)methyl]-3-(4-methoxyphenyl)-2,3-dihydrothiophene-2-carboxamide IUPAC Name: 5-amino-4-cyano-N-(dimethylcarbamoyl)-3-(4-methoxyphenyl)-2,3-dihydrothiophene-2-carboxamide Traditional Name: 5-amino-4-cyano-N-(dimethylcarbamoyl)-3-(4-methoxyphenyl)-2,3-dihydrothiophene-2-carboxamide Formula: C16H18N4O3S MolecularWeight: 346.40412

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)NC(=O)C1C(C(=C(S1)N)C#N)C2=CC=C(C=C2)OC

Isomeric SMILES

CN(C)C(=O)NC(=O)C1C(C(=C(S1)N)C#N)C2=CC=C(C=C2)OC

InChI

InChI=1S/C16H18N4O3S/c1-20(2)16(22)19-15(21)13-12(11(8-17)14(18)24-13)9-4-6-10(23-3)7-5-9/h4-7,12-13H,18H2,1-3H3,(H,19,21,22)