1-butyl-6-methylsulfanyl-2,4-bis(oxidanylidene)pyrimidine-5-carbonitrile

Systemtic Name: 1-butyl-6-methylsulfanyl-2,4-bis(oxidanylidene)pyrimidine-5-carbonitrile Openeye Name: 1-butyl-6-methylsulfanyl-2,4-dioxo-pyrimidine-5-carbonitrile CAS Name: 1-butyl-6-(methylthio)-2,4-dioxo-5-pyrimidinecarbonitrile IUPAC Name: 1-butyl-6-methylsulfanyl-2,4-dioxopyrimidine-5-carbonitrile Traditional Name: 1-butyl-2,4-diketo-6-(methylthio)pyrimidine-5-carbonitrile Formula: C10H13N3O2S MolecularWeight: 239.29412

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)C#N)SC

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)C#N)SC

InChI

InChI=1S/C10H13N3O2S/c1-3-4-5-13-9(16-2)7(6-11)8(14)12-10(13)15/h3-5H2,1-2H3,(H,12,14,15)