4-azanyl-2-[(3-methyl-4-oxidanylidene-quinazolin-2-yl)methylsulfanyl]pyrimidine-5-carbonitrile

Systemtic Name: 4-azanyl-2-[(3-methyl-4-oxidanylidene-quinazolin-2-yl)methylsulfanyl]pyrimidine-5-carbonitrile Openeye Name: 4-amino-2-[(3-methyl-4-oxo-quinazolin-2-yl)methylsulfanyl]pyrimidine-5-carbonitrile CAS Name: 4-amino-2-[(3-methyl-4-oxo-2-quinazolinyl)methylthio]-5-pyrimidinecarbonitrile IUPAC Name: 4-amino-2-[(3-methyl-4-oxoquinazolin-2-yl)methylsulfanyl]pyrimidine-5-carbonitrile Traditional Name: 4-amino-2-[(4-keto-3-methyl-quinazolin-2-yl)methylthio]pyrimidine-5-carbonitrile Formula: C15H12N6OS MolecularWeight: 324.36038

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC2=CC=CC=C2C1=O)CSC3=NC=C(C(=N3)N)C#N

Isomeric SMILES

CN1C(=NC2=CC=CC=C2C1=O)CSC3=NC=C(C(=N3)N)C#N

InChI

InChI=1S/C15H12N6OS/c1-21-12(19-11-5-3-2-4-10(11)14(21)22)8-23-15-18-7-9(6-16)13(17)20-15/h2-5,7H,8H2,1H3,(H2,17,18,20)