1-[(2-chlorophenyl)methyl]-6-cyclohexyl-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one

Systemtic Name: 1-[(2-chlorophenyl)methyl]-6-cyclohexyl-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one Openeye Name: 1-[(2-chlorophenyl)methyl]-6-cyclohexyl-2-thioxo-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one CAS Name: 1-[(2-chlorophenyl)methyl]-6-cyclohexyl-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one IUPAC Name: 1-[(2-chlorophenyl)methyl]-6-cyclohexyl-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one Traditional Name: 1-(2-chlorobenzyl)-6-cyclohexyl-2-thioxo-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one Formula: C19H23ClN4OS MolecularWeight: 390.93012

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CC3=C(NC2)N(C(=S)NC3=O)CC4=CC=CC=C4Cl

Isomeric SMILES

C1CCC(CC1)N2CC3=C(NC2)N(C(=S)NC3=O)CC4=CC=CC=C4Cl

InChI

InChI=1S/C19H23ClN4OS/c20-16-9-5-4-6-13(16)10-24-17-15(18(25)22-19(24)26)11-23(12-21-17)14-7-2-1-3-8-14/h4-6,9,14,21H,1-3,7-8,10-12H2,(H,22,25,26)