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

Systemtic Name: 6-cyclohexyl-1-(pyridin-4-ylmethyl)-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one Openeye Name: 6-cyclohexyl-1-(4-pyridylmethyl)-2-thioxo-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one CAS Name: 6-cyclohexyl-1-(pyridin-4-ylmethyl)-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one IUPAC Name: 6-cyclohexyl-1-(pyridin-4-ylmethyl)-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one Traditional Name: 6-cyclohexyl-1-(4-pyridylmethyl)-2-thioxo-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one Formula: C18H23N5OS MolecularWeight: 357.47312

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CC3=C(NC2)N(C(=S)NC3=O)CC4=CC=NC=C4

Isomeric SMILES

C1CCC(CC1)N2CC3=C(NC2)N(C(=S)NC3=O)CC4=CC=NC=C4

InChI

InChI=1S/C18H23N5OS/c24-17-15-11-22(14-4-2-1-3-5-14)12-20-16(15)23(18(25)21-17)10-13-6-8-19-9-7-13/h6-9,14,20H,1-5,10-12H2,(H,21,24,25)