2-azanyl-4-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)-1-(4-methoxyphenyl)-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-methoxyphenyl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)-1-(4-methoxyphenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)-1-(4-methoxyphenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)-1-(4-methoxyphenyl)-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-(4-methoxyphenyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C27H24ClN5O2 MolecularWeight: 485.96476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C2C(=C(N(C3=C2C(=O)CCC3)C4=CC=C(C=C4)OC)N)C#N)Cl)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1C2C(=C(N(C3=C2C(=O)CCC3)C4=CC=C(C=C4)OC)N)C#N)Cl)C5=CC=CC=C5

InChI

InChI=1S/C27H24ClN5O2/c1-16-23(26(28)33(31-16)18-7-4-3-5-8-18)24-20(15-29)27(30)32(17-11-13-19(35-2)14-12-17)21-9-6-10-22(34)25(21)24/h3-5,7-8,11-14,24H,6,9-10,30H2,1-2H3