5-tert-butyl-1-(4-chlorophenyl)-N'-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]carbonyl-pyrazole-3-carbohydrazide

Systemtic Name: 5-tert-butyl-1-(4-chlorophenyl)-N'-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]carbonyl-pyrazole-3-carbohydrazide Openeye Name: 5-tert-butyl-1-(4-chlorophenyl)-N'-[4-methyl-3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]benzoyl]pyrazole-3-carbohydrazide CAS Name: 5-tert-butyl-1-(4-chlorophenyl)-N'-[[4-methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]phenyl]-oxomethyl]-3-pyrazolecarbohydrazide IUPAC Name: 5-tert-butyl-1-(4-chlorophenyl)-N'-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]benzoyl]pyrazole-3-carbohydrazide Traditional Name: 5-tert-butyl-1-(4-chlorophenyl)-N'-[4-methyl-3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]benzoyl]pyrazole-3-carbohydrazide Formula: C31H29ClN8O2 MolecularWeight: 581.06736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NNC(=O)C2=NN(C(=C2)C(C)(C)C)C3=CC=C(C=C3)Cl)NC4=NC=CC(=N4)C5=CN=CC=C5

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NNC(=O)C2=NN(C(=C2)C(C)(C)C)C3=CC=C(C=C3)Cl)NC4=NC=CC(=N4)C5=CN=CC=C5

InChI

InChI=1S/C31H29ClN8O2/c1-19-7-8-20(16-25(19)36-30-34-15-13-24(35-30)21-6-5-14-33-18-21)28(41)37-38-29(42)26-17-27(31(2,3)4)40(39-26)23-11-9-22(32)10-12-23/h5-18H,1-4H3,(H,37,41)(H,38,42)(H,34,35,36)