1-(2-azanyl-5-cyano-4-methylsulfanyl-6-oxidanylidene-pyrimidin-1-yl)-3-phenyl-thiourea

Systemtic Name: 1-(2-azanyl-5-cyano-4-methylsulfanyl-6-oxidanylidene-pyrimidin-1-yl)-3-phenyl-thiourea Openeye Name: 1-(2-amino-5-cyano-4-methylsulfanyl-6-oxo-pyrimidin-1-yl)-3-phenyl-thiourea CAS Name: 1-[2-amino-5-cyano-4-(methylthio)-6-oxo-1-pyrimidinyl]-3-phenylthiourea IUPAC Name: 1-(2-amino-5-cyano-4-methylsulfanyl-6-oxopyrimidin-1-yl)-3-phenylthiourea Traditional Name: 1-[2-amino-5-cyano-6-keto-4-(methylthio)pyrimidin-1-yl]-3-phenyl-thiourea Formula: C13H12N6OS2 MolecularWeight: 332.40398

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=O)N(C(=N1)N)NC(=S)NC2=CC=CC=C2)C#N

Isomeric SMILES

CSC1=C(C(=O)N(C(=N1)N)NC(=S)NC2=CC=CC=C2)C#N

InChI

InChI=1S/C13H12N6OS2/c1-22-10-9(7-14)11(20)19(12(15)17-10)18-13(21)16-8-5-3-2-4-6-8/h2-6H,1H3,(H2,15,17)(H2,16,18,21)