2-azanyl-6-(1H-imidazol-2-ylmethylsulfanyl)-4-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1H-pyridine-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-6-(1H-imidazol-2-ylmethylsulfanyl)-4-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1H-pyridine-3,5-dicarbonitrile Openeye Name: 2-amino-6-(1H-imidazol-2-ylmethylsulfanyl)-4-(4-oxocyclohexa-2,5-dien-1-ylidene)-1H-pyridine-3,5-dicarbonitrile CAS Name: 2-amino-6-(1H-imidazol-2-ylmethylthio)-4-(4-oxo-1-cyclohexa-2,5-dienylidene)-1H-pyridine-3,5-dicarbonitrile IUPAC Name: 2-amino-6-(1H-imidazol-2-ylmethylsulfanyl)-4-(4-oxocyclohexa-2,5-dien-1-ylidene)-1H-pyridine-3,5-dicarbonitrile Traditional Name: 2-amino-6-(1H-imidazol-2-ylmethylthio)-4-(4-ketocyclohexa-2,5-dien-1-ylidene)-1H-pyridine-3,5-dicarbonitrile Formula: C17H12N6OS MolecularWeight: 348.38178

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C=CC1=C2C(=C(NC(=C2C#N)SCC3=NC=CN3)N)C#N

Isomeric SMILES

C1=CC(=O)C=CC1=C2C(=C(NC(=C2C#N)SCC3=NC=CN3)N)C#N

InChI

InChI=1S/C17H12N6OS/c18-7-12-15(10-1-3-11(24)4-2-10)13(8-19)17(23-16(12)20)25-9-14-21-5-6-22-14/h1-6,23H,9,20H2,(H,21,22)