4-[(2-methylsulfanyl-4-oxidanylidene-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-[(2-methylsulfanyl-4-oxidanylidene-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-yl)methyl]benzenecarbonitrile Openeye Name: 4-[(2-methylsulfanyl-4-oxo-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-yl)methyl]benzonitrile CAS Name: 4-[[2-(methylthio)-4-oxo-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-yl]methyl]benzonitrile IUPAC Name: 4-[(2-methylsulfanyl-4-oxo-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-yl)methyl]benzonitrile Traditional Name: 4-[[4-keto-2-(methylthio)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-yl]methyl]benzonitrile Formula: C16H15N3OS MolecularWeight: 297.3748

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(CCC2)C(=O)N1CC3=CC=C(C=C3)C#N

Isomeric SMILES

CSC1=NC2=C(CCC2)C(=O)N1CC3=CC=C(C=C3)C#N

InChI

InChI=1S/C16H15N3OS/c1-21-16-18-14-4-2-3-13(14)15(20)19(16)10-12-7-5-11(9-17)6-8-12/h5-8H,2-4,10H2,1H3