4-azanyl-8,8-dimethyl-5-(4-methylsulfanylphenyl)-2-piperidin-1-yl-5,7,9,10-tetrahydropyrimido[4,5-b]quinolin-6-one

Systemtic Name: 4-azanyl-8,8-dimethyl-5-(4-methylsulfanylphenyl)-2-piperidin-1-yl-5,7,9,10-tetrahydropyrimido[4,5-b]quinolin-6-one Openeye Name: 4-amino-8,8-dimethyl-5-(4-methylsulfanylphenyl)-2-(1-piperidyl)-5,7,9,10-tetrahydropyrimido[4,5-b]quinolin-6-one CAS Name: 4-amino-8,8-dimethyl-5-[4-(methylthio)phenyl]-2-(1-piperidinyl)-5,7,9,10-tetrahydropyrimido[4,5-b]quinolin-6-one IUPAC Name: 4-amino-8,8-dimethyl-5-(4-methylsulfanylphenyl)-2-piperidin-1-yl-5,7,9,10-tetrahydropyrimido[4,5-b]quinolin-6-one Traditional Name: 4-amino-8,8-dimethyl-5-[4-(methylthio)phenyl]-2-piperidino-5,7,9,10-tetrahydropyrimido[4,5-b]quinolin-6-one Formula: C25H31N5OS MolecularWeight: 449.61154

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C3=C(N2)N=C(N=C3N)N4CCCCC4)C5=CC=C(C=C5)SC)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C3=C(N2)N=C(N=C3N)N4CCCCC4)C5=CC=C(C=C5)SC)C(=O)C1)C

InChI

InChI=1S/C25H31N5OS/c1-25(2)13-17-20(18(31)14-25)19(15-7-9-16(32-3)10-8-15)21-22(26)28-24(29-23(21)27-17)30-11-5-4-6-12-30/h7-10,19H,4-6,11-14H2,1-3H3,(H3,26,27,28,29)