6-azanyl-5-cyano-4-(4-nitrophenyl)-2-sulfanylidene-3,4-dihydro-1H-pyridine-3-carboxamide

Systemtic Name: 6-azanyl-5-cyano-4-(4-nitrophenyl)-2-sulfanylidene-3,4-dihydro-1H-pyridine-3-carboxamide Openeye Name: 6-amino-5-cyano-4-(4-nitrophenyl)-2-thioxo-3,4-dihydro-1H-pyridine-3-carboxamide CAS Name: 6-amino-5-cyano-4-(4-nitrophenyl)-2-sulfanylidene-3,4-dihydro-1H-pyridine-3-carboxamide IUPAC Name: 6-amino-5-cyano-4-(4-nitrophenyl)-2-sulfanylidene-3,4-dihydro-1H-pyridine-3-carboxamide Traditional Name: 6-amino-5-cyano-4-(4-nitrophenyl)-2-thioxo-3,4-dihydro-1H-pyridine-3-carboxamide Formula: C13H11N5O3S MolecularWeight: 317.32314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2C(C(=S)NC(=C2C#N)N)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2C(C(=S)NC(=C2C#N)N)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C13H11N5O3S/c14-5-8-9(6-1-3-7(4-2-6)18(20)21)10(12(16)19)13(22)17-11(8)15/h1-4,9-10H,15H2,(H2,16,19)(H,17,22)