(5S)-4-azanyl-8,8-dimethyl-2-methylsulfanyl-5-pyridin-4-yl-5,7,9,10-tetrahydropyrimido[4,5-b]quinolin-6-one

Systemtic Name: (5S)-4-azanyl-8,8-dimethyl-2-methylsulfanyl-5-pyridin-4-yl-5,7,9,10-tetrahydropyrimido[4,5-b]quinolin-6-one Openeye Name: (5S)-4-amino-8,8-dimethyl-2-methylsulfanyl-5-(4-pyridyl)-5,7,9,10-tetrahydropyrimido[4,5-b]quinolin-6-one CAS Name: (5S)-4-amino-8,8-dimethyl-2-(methylthio)-5-pyridin-4-yl-5,7,9,10-tetrahydropyrimido[4,5-b]quinolin-6-one IUPAC Name: (5S)-4-amino-8,8-dimethyl-2-methylsulfanyl-5-pyridin-4-yl-5,7,9,10-tetrahydropyrimido[4,5-b]quinolin-6-one Traditional Name: (5S)-4-amino-8,8-dimethyl-2-(methylthio)-5-(4-pyridyl)-5,7,9,10-tetrahydropyrimido[4,5-b]quinolin-6-one Formula: C19H21N5OS MolecularWeight: 367.46794

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C3=C(N2)N=C(N=C3N)SC)C4=CC=NC=C4)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C([C@H](C3=C(N2)N=C(N=C3N)SC)C4=CC=NC=C4)C(=O)C1)C

InChI

InChI=1S/C19H21N5OS/c1-19(2)8-11-14(12(25)9-19)13(10-4-6-21-7-5-10)15-16(20)23-18(26-3)24-17(15)22-11/h4-7,13H,8-9H2,1-3H3,(H3,20,22,23,24)/t13-/m1/s1