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

Systemtic Name: 2-[2-[(2-chlorophenyl)methylsulfanyl]-4-oxidanylidene-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-yl]ethanenitrile Openeye Name: 2-[2-[(2-chlorophenyl)methylsulfanyl]-4-oxo-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-yl]acetonitrile CAS Name: 2-[2-[(2-chlorophenyl)methylthio]-4-oxo-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-yl]acetonitrile IUPAC Name: 2-[2-[(2-chlorophenyl)methylsulfanyl]-4-oxo-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-yl]acetonitrile Traditional Name: 2-[2-[(2-chlorobenzyl)thio]-4-keto-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-yl]acetonitrile Formula: C16H14ClN3OS MolecularWeight: 331.81986

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)N=C(N(C2=O)CC#N)SCC3=CC=CC=C3Cl

Isomeric SMILES

C1CC2=C(C1)N=C(N(C2=O)CC#N)SCC3=CC=CC=C3Cl

InChI

InChI=1S/C16H14ClN3OS/c17-13-6-2-1-4-11(13)10-22-16-19-14-7-3-5-12(14)15(21)20(16)9-8-18/h1-2,4,6H,3,5,7,9-10H2