8-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-9-(4-methylphenyl)-3H-purin-6-one

Systemtic Name: 8-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-9-(4-methylphenyl)-3H-purin-6-one Openeye Name: 8-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxo-ethyl]sulfanyl-9-(p-tolyl)-3H-purin-6-one CAS Name: 8-[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]thio]-9-(4-methylphenyl)-3H-purin-6-one IUPAC Name: 8-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanyl-9-(4-methylphenyl)-3H-purin-6-one Traditional Name: 8-[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-keto-ethyl]thio]-9-(p-tolyl)-3H-purin-6-one Formula: C23H21N5O2S MolecularWeight: 431.51014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C3=C(C(=O)N=CN3)N=C2SCC(=O)N4CCCC5=CC=CC=C54

Isomeric SMILES

CC1=CC=C(C=C1)N2C3=C(C(=O)N=CN3)N=C2SCC(=O)N4CCCC5=CC=CC=C54

InChI

InChI=1S/C23H21N5O2S/c1-15-8-10-17(11-9-15)28-21-20(22(30)25-14-24-21)26-23(28)31-13-19(29)27-12-4-6-16-5-2-3-7-18(16)27/h2-3,5,7-11,14H,4,6,12-13H2,1H3,(H,24,25,30)