1-[2-(3-chlorophenyl)ethyl]-6-propyl-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one

Systemtic Name: 1-[2-(3-chlorophenyl)ethyl]-6-propyl-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one Openeye Name: 1-[2-(3-chlorophenyl)ethyl]-6-propyl-2-thioxo-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one CAS Name: 1-[2-(3-chlorophenyl)ethyl]-6-propyl-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one IUPAC Name: 1-[2-(3-chlorophenyl)ethyl]-6-propyl-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one Traditional Name: 1-[2-(3-chlorophenyl)ethyl]-6-propyl-2-thioxo-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one Formula: C17H21ClN4OS MolecularWeight: 364.89284

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CC2=C(NC1)N(C(=S)NC2=O)CCC3=CC(=CC=C3)Cl

Isomeric SMILES

CCCN1CC2=C(NC1)N(C(=S)NC2=O)CCC3=CC(=CC=C3)Cl

InChI

InChI=1S/C17H21ClN4OS/c1-2-7-21-10-14-15(19-11-21)22(17(24)20-16(14)23)8-6-12-4-3-5-13(18)9-12/h3-5,9,19H,2,6-8,10-11H2,1H3,(H,20,23,24)