2-azanyl-4-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)-1-(4-methylphenyl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)-1-(4-methylphenyl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)-5-oxo-1-(p-tolyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)-1-(4-methylphenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)-1-(4-methylphenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)-5-keto-1-(p-tolyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C27H24ClN5O MolecularWeight: 469.96536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C3=C(C(C(=C2N)C#N)C4=C(N(N=C4C)C5=CC=CC=C5)Cl)C(=O)CCC3

Isomeric SMILES

CC1=CC=C(C=C1)N2C3=C(C(C(=C2N)C#N)C4=C(N(N=C4C)C5=CC=CC=C5)Cl)C(=O)CCC3

InChI

InChI=1S/C27H24ClN5O/c1-16-11-13-18(14-12-16)32-21-9-6-10-22(34)25(21)24(20(15-29)27(32)30)23-17(2)31-33(26(23)28)19-7-4-3-5-8-19/h3-5,7-8,11-14,24H,6,9-10,30H2,1-2H3