2-azanyl-1-(4-bromophenyl)-4-[5-chloranyl-3-methyl-1-(4-methylphenyl)pyrazol-4-yl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile

Systemtic Name: 2-azanyl-1-(4-bromophenyl)-4-[5-chloranyl-3-methyl-1-(4-methylphenyl)pyrazol-4-yl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: 2-amino-1-(4-bromophenyl)-4-[5-chloro-3-methyl-1-(p-tolyl)pyrazol-4-yl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: 2-amino-1-(4-bromophenyl)-4-[5-chloro-3-methyl-1-(4-methylphenyl)-4-pyrazolyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: 2-amino-1-(4-bromophenyl)-4-[5-chloro-3-methyl-1-(4-methylphenyl)pyrazol-4-yl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: 2-amino-1-(4-bromophenyl)-4-[5-chloro-3-methyl-1-(p-tolyl)pyrazol-4-yl]-5-keto-7,7-dimethyl-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C29H27BrClN5O MolecularWeight: 576.91458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C(=N2)C)C3C(=C(N(C4=C3C(=O)CC(C4)(C)C)C5=CC=C(C=C5)Br)N)C#N)Cl

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C(=N2)C)C3C(=C(N(C4=C3C(=O)CC(C4)(C)C)C5=CC=C(C=C5)Br)N)C#N)Cl

InChI

InChI=1S/C29H27BrClN5O/c1-16-5-9-20(10-6-16)36-27(31)24(17(2)34-36)25-21(15-32)28(33)35(19-11-7-18(30)8-12-19)22-13-29(3,4)14-23(37)26(22)25/h5-12,25H,13-14,33H2,1-4H3