5-(1,3-benzodioxol-5-yl)-7-methyl-2-methylsulfanyl-4-oxidanylidene-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carbonitrile

Systemtic Name: 5-(1,3-benzodioxol-5-yl)-7-methyl-2-methylsulfanyl-4-oxidanylidene-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carbonitrile Openeye Name: 5-(1,3-benzodioxol-5-yl)-7-methyl-2-methylsulfanyl-4-oxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carbonitrile CAS Name: 5-(1,3-benzodioxol-5-yl)-7-methyl-2-(methylthio)-4-oxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carbonitrile IUPAC Name: 5-(1,3-benzodioxol-5-yl)-7-methyl-2-methylsulfanyl-4-oxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carbonitrile Traditional Name: 5-(1,3-benzodioxol-5-yl)-4-keto-7-methyl-2-(methylthio)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carbonitrile Formula: C17H14N4O3S MolecularWeight: 354.38306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(N1)NC(=NC2=O)SC)C3=CC4=C(C=C3)OCO4)C#N

Isomeric SMILES

CC1=C(C(C2=C(N1)NC(=NC2=O)SC)C3=CC4=C(C=C3)OCO4)C#N

InChI

InChI=1S/C17H14N4O3S/c1-8-10(6-18)13(9-3-4-11-12(5-9)24-7-23-11)14-15(19-8)20-17(25-2)21-16(14)22/h3-5,13H,7H2,1-2H3,(H2,19,20,21,22)