1-[2-(2-methylphenyl)ethyl]-6-propyl-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one

Systemtic Name: 1-[2-(2-methylphenyl)ethyl]-6-propyl-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one Openeye Name: 1-[2-(o-tolyl)ethyl]-6-propyl-2-thioxo-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one CAS Name: 1-[2-(2-methylphenyl)ethyl]-6-propyl-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one IUPAC Name: 1-[2-(2-methylphenyl)ethyl]-6-propyl-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one Traditional Name: 1-[2-(o-tolyl)ethyl]-6-propyl-2-thioxo-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one Formula: C18H24N4OS MolecularWeight: 344.47436

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CC2=C(NC1)N(C(=S)NC2=O)CCC3=CC=CC=C3C

Isomeric SMILES

CCCN1CC2=C(NC1)N(C(=S)NC2=O)CCC3=CC=CC=C3C

InChI

InChI=1S/C18H24N4OS/c1-3-9-21-11-15-16(19-12-21)22(18(24)20-17(15)23)10-8-14-7-5-4-6-13(14)2/h4-7,19H,3,8-12H2,1-2H3,(H,20,23,24)