[azanyl-[(5-cyano-3-methoxycarbonyl-6-oxidanylidene-4-phenyl-1H-pyridin-2-yl)methylsulfanyl]methylidene]azanium

Systemtic Name: [azanyl-[(5-cyano-3-methoxycarbonyl-6-oxidanylidene-4-phenyl-1H-pyridin-2-yl)methylsulfanyl]methylidene]azanium Openeye Name: [amino-[(5-cyano-3-methoxycarbonyl-6-oxo-4-phenyl-1H-pyridin-2-yl)methylsulfanyl]methylene]ammonium CAS Name: [amino-[(5-cyano-3-methoxycarbonyl-6-oxo-4-phenyl-1H-pyridin-2-yl)methylthio]methylidene]ammonium IUPAC Name: [amino-[(5-cyano-3-methoxycarbonyl-6-oxo-4-phenyl-1H-pyridin-2-yl)methylsulfanyl]methylidene]azanium Traditional Name: [amino-[(3-carbomethoxy-5-cyano-6-keto-4-phenyl-1H-pyridin-2-yl)methylthio]methylene]ammonium Formula: C16H15N4O3S+ MolecularWeight: 343.3803

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(NC(=O)C(=C1C2=CC=CC=C2)C#N)CSC(=[NH2+])N

Isomeric SMILES

COC(=O)C1=C(NC(=O)C(=C1C2=CC=CC=C2)C#N)CSC(=[NH2+])N

InChI

InChI=1S/C16H14N4O3S/c1-23-15(22)13-11(8-24-16(18)19)20-14(21)10(7-17)12(13)9-5-3-2-4-6-9/h2-6H,8H2,1H3,(H3,18,19)(H,20,21)/p+1