4-butyl-N-[2-[[2-(2-chlorophenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-N-propan-2-yl-benzamide

Systemtic Name: 4-butyl-N-[2-[[2-(2-chlorophenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-N-propan-2-yl-benzamide Openeye Name: 4-butyl-N-[2-[[2-(2-chlorophenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxo-ethyl]-N-isopropyl-benzamide CAS Name: 4-butyl-N-[2-[[2-(2-chlorophenyl)-5-phenyl-3-pyrazolyl]amino]-2-oxoethyl]-N-propan-2-ylbenzamide IUPAC Name: 4-butyl-N-[2-[[2-(2-chlorophenyl)-5-phenylpyrazol-3-yl]amino]-2-oxoethyl]-N-propan-2-ylbenzamide Traditional Name: 4-butyl-N-[2-[[2-(2-chlorophenyl)-5-phenyl-pyrazol-3-yl]amino]-2-keto-ethyl]-N-isopropyl-benzamide Formula: C31H33ClN4O2 MolecularWeight: 529.07232

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)N(CC(=O)NC2=CC(=NN2C3=CC=CC=C3Cl)C4=CC=CC=C4)C(C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)N(CC(=O)NC2=CC(=NN2C3=CC=CC=C3Cl)C4=CC=CC=C4)C(C)C

InChI

InChI=1S/C31H33ClN4O2/c1-4-5-11-23-16-18-25(19-17-23)31(38)35(22(2)3)21-30(37)33-29-20-27(24-12-7-6-8-13-24)34-36(29)28-15-10-9-14-26(28)32/h6-10,12-20,22H,4-5,11,21H2,1-3H3,(H,33,37)