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

Systemtic Name: 2-azanyl-1-(3-bromophenyl)-3-(4-methylphenyl)carbonyl-4-(4-methylsulfanylphenyl)-4,6,7,8-tetrahydroquinolin-5-one Openeye Name: 2-amino-1-(3-bromophenyl)-3-(4-methylbenzoyl)-4-(4-methylsulfanylphenyl)-4,6,7,8-tetrahydroquinolin-5-one CAS Name: 2-amino-1-(3-bromophenyl)-3-[(4-methylphenyl)-oxomethyl]-4-[4-(methylthio)phenyl]-4,6,7,8-tetrahydroquinolin-5-one IUPAC Name: 2-amino-1-(3-bromophenyl)-3-(4-methylbenzoyl)-4-(4-methylsulfanylphenyl)-4,6,7,8-tetrahydroquinolin-5-one Traditional Name: 2-amino-1-(3-bromophenyl)-4-[4-(methylthio)phenyl]-3-p-toluoyl-4,6,7,8-tetrahydroquinolin-5-one Formula: C30H27BrN2O2S MolecularWeight: 559.51658

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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=CC(=CC=C5)Br)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=CC(=CC=C5)Br)N

InChI

InChI=1S/C30H27BrN2O2S/c1-18-9-11-20(12-10-18)29(35)28-26(19-13-15-23(36-2)16-14-19)27-24(7-4-8-25(27)34)33(30(28)32)22-6-3-5-21(31)17-22/h3,5-6,9-17,26H,4,7-8,32H2,1-2H3