6-azanyl-2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-1-(3-methylphenyl)pyrimidin-4-one

Systemtic Name: 6-azanyl-2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-1-(3-methylphenyl)pyrimidin-4-one Openeye Name: 6-amino-2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxo-ethyl]sulfanyl-1-(m-tolyl)pyrimidin-4-one CAS Name: 6-amino-2-[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]thio]-1-(3-methylphenyl)-4-pyrimidinone IUPAC Name: 6-amino-2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanyl-1-(3-methylphenyl)pyrimidin-4-one Traditional Name: 6-amino-2-[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-keto-ethyl]thio]-1-(m-tolyl)pyrimidin-4-one Formula: C22H22N4O2S MolecularWeight: 406.50068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=CC(=O)N=C2SCC(=O)N3CCCC4=CC=CC=C43)N

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=CC(=O)N=C2SCC(=O)N3CCCC4=CC=CC=C43)N

InChI

InChI=1S/C22H22N4O2S/c1-15-6-4-9-17(12-15)26-19(23)13-20(27)24-22(26)29-14-21(28)25-11-5-8-16-7-2-3-10-18(16)25/h2-4,6-7,9-10,12-13H,5,8,11,14,23H2,1H3