4-azanyl-2-(3-oxidanylidenebutylsulfanyl)pyrimidine-5-carbonitrile

Systemtic Name: 4-azanyl-2-(3-oxidanylidenebutylsulfanyl)pyrimidine-5-carbonitrile Openeye Name: 4-amino-2-(3-oxobutylsulfanyl)pyrimidine-5-carbonitrile CAS Name: 4-amino-2-(3-oxobutylthio)-5-pyrimidinecarbonitrile IUPAC Name: 4-amino-2-(3-oxobutylsulfanyl)pyrimidine-5-carbonitrile Traditional Name: 4-amino-2-(3-ketobutylthio)pyrimidine-5-carbonitrile Formula: C9H10N4OS MolecularWeight: 222.2669

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCSC1=NC=C(C(=N1)N)C#N

Isomeric SMILES

CC(=O)CCSC1=NC=C(C(=N1)N)C#N

InChI

InChI=1S/C9H10N4OS/c1-6(14)2-3-15-9-12-5-7(4-10)8(11)13-9/h5H,2-3H2,1H3,(H2,11,12,13)