2-azanyl-4-methylsulfanyl-6-oxidanylidene-1-[(E)-(phenylmethylidene)amino]pyrimidine-5-carbonitrile

Systemtic Name: 2-azanyl-4-methylsulfanyl-6-oxidanylidene-1-[(E)-(phenylmethylidene)amino]pyrimidine-5-carbonitrile Openeye Name: 2-amino-1-[(E)-benzylideneamino]-4-methylsulfanyl-6-oxo-pyrimidine-5-carbonitrile CAS Name: 2-amino-4-(methylthio)-6-oxo-1-[(E)-(phenylmethylene)amino]-5-pyrimidinecarbonitrile IUPAC Name: 2-amino-1-[(E)-benzylideneamino]-4-methylsulfanyl-6-oxopyrimidine-5-carbonitrile Traditional Name: 2-amino-1-[(E)-benzalamino]-6-keto-4-(methylthio)pyrimidine-5-carbonitrile Formula: C13H11N5OS MolecularWeight: 285.32434

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=O)N(C(=N1)N)N=CC2=CC=CC=C2)C#N

Isomeric SMILES

CSC1=C(C(=O)N(C(=N1)N)/N=C/C2=CC=CC=C2)C#N

InChI

InChI=1S/C13H11N5OS/c1-20-11-10(7-14)12(19)18(13(15)17-11)16-8-9-5-3-2-4-6-9/h2-6,8H,1H3,(H2,15,17)/b16-8+