2-azanyl-3-(4-methylphenyl)carbonyl-4-(4-methylsulfanylphenyl)-1-pyridin-3-yl-4,6,7,8-tetrahydroquinolin-5-one

Systemtic Name: 2-azanyl-3-(4-methylphenyl)carbonyl-4-(4-methylsulfanylphenyl)-1-pyridin-3-yl-4,6,7,8-tetrahydroquinolin-5-one Openeye Name: 2-amino-3-(4-methylbenzoyl)-4-(4-methylsulfanylphenyl)-1-(3-pyridyl)-4,6,7,8-tetrahydroquinolin-5-one CAS Name: 2-amino-3-[(4-methylphenyl)-oxomethyl]-4-[4-(methylthio)phenyl]-1-(3-pyridinyl)-4,6,7,8-tetrahydroquinolin-5-one IUPAC Name: 2-amino-3-(4-methylbenzoyl)-4-(4-methylsulfanylphenyl)-1-pyridin-3-yl-4,6,7,8-tetrahydroquinolin-5-one Traditional Name: 2-amino-4-[4-(methylthio)phenyl]-3-p-toluoyl-1-(3-pyridyl)-4,6,7,8-tetrahydroquinolin-5-one Formula: C29H27N3O2S MolecularWeight: 481.60858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=C(N(C3=C(C2C4=CC=C(C=C4)SC)C(=O)CCC3)C5=CN=CC=C5)N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=C(N(C3=C(C2C4=CC=C(C=C4)SC)C(=O)CCC3)C5=CN=CC=C5)N

InChI

InChI=1S/C29H27N3O2S/c1-18-8-10-20(11-9-18)28(34)27-25(19-12-14-22(35-2)15-13-19)26-23(6-3-7-24(26)33)32(29(27)30)21-5-4-16-31-17-21/h4-5,8-17,25H,3,6-7,30H2,1-2H3