2-[4-(4-chlorophenyl)-6-methyl-pyrimidin-2-yl]sulfanyl-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone

Systemtic Name: 2-[4-(4-chlorophenyl)-6-methyl-pyrimidin-2-yl]sulfanyl-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone Openeye Name: 2-[4-(4-chlorophenyl)-6-methyl-pyrimidin-2-yl]sulfanyl-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone CAS Name: 2-[[4-(4-chlorophenyl)-6-methyl-2-pyrimidinyl]thio]-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone IUPAC Name: 2-[4-(4-chlorophenyl)-6-methylpyrimidin-2-yl]sulfanyl-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone Traditional Name: 2-[[4-(4-chlorophenyl)-6-methyl-pyrimidin-2-yl]thio]-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone Formula: C22H20ClN3OS MolecularWeight: 409.9317

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC=C(C=C2)Cl)SCC(=O)N3CCCC4=CC=CC=C43

Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC=C(C=C2)Cl)SCC(=O)N3CCCC4=CC=CC=C43

InChI

InChI=1S/C22H20ClN3OS/c1-15-13-19(16-8-10-18(23)11-9-16)25-22(24-15)28-14-21(27)26-12-4-6-17-5-2-3-7-20(17)26/h2-3,5,7-11,13H,4,6,12,14H2,1H3