2-[(3-chlorophenyl)methylsulfanyl]-6-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]-1H-pyrimidin-4-one

Systemtic Name: 2-[(3-chlorophenyl)methylsulfanyl]-6-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]-1H-pyrimidin-4-one Openeye Name: 2-[(3-chlorophenyl)methylsulfanyl]-6-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxo-ethyl]-1H-pyrimidin-4-one CAS Name: 2-[(3-chlorophenyl)methylthio]-6-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-1H-pyrimidin-4-one IUPAC Name: 2-[(3-chlorophenyl)methylsulfanyl]-6-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-1H-pyrimidin-4-one Traditional Name: 2-[(3-chlorobenzyl)thio]-6-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-keto-ethyl]-1H-pyrimidin-4-one Formula: C22H20ClN3O2S MolecularWeight: 425.9311

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C1)C(=O)CC3=CC(=O)N=C(N3)SCC4=CC(=CC=C4)Cl

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)C(=O)CC3=CC(=O)N=C(N3)SCC4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H20ClN3O2S/c23-17-8-3-5-15(11-17)14-29-22-24-18(12-20(27)25-22)13-21(28)26-10-4-7-16-6-1-2-9-19(16)26/h1-3,5-6,8-9,11-12H,4,7,10,13-14H2,(H,24,25,27)