N-butyl-N-[2-[[5-tert-butyl-2-(2-methylphenyl)pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-3-chloranyl-benzamide

Systemtic Name: N-butyl-N-[2-[[5-tert-butyl-2-(2-methylphenyl)pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-3-chloranyl-benzamide Openeye Name: N-butyl-N-[2-[[5-tert-butyl-2-(o-tolyl)pyrazol-3-yl]amino]-2-oxo-ethyl]-3-chloro-benzamide CAS Name: N-butyl-N-[2-[[5-tert-butyl-2-(2-methylphenyl)-3-pyrazolyl]amino]-2-oxoethyl]-3-chlorobenzamide IUPAC Name: N-butyl-N-[2-[[5-tert-butyl-2-(2-methylphenyl)pyrazol-3-yl]amino]-2-oxoethyl]-3-chlorobenzamide Traditional Name: N-butyl-N-[2-[[5-tert-butyl-2-(o-tolyl)pyrazol-3-yl]amino]-2-keto-ethyl]-3-chloro-benzamide Formula: C27H33ClN4O2 MolecularWeight: 481.02952

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)NC1=CC(=NN1C2=CC=CC=C2C)C(C)(C)C)C(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

CCCCN(CC(=O)NC1=CC(=NN1C2=CC=CC=C2C)C(C)(C)C)C(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C27H33ClN4O2/c1-6-7-15-31(26(34)20-12-10-13-21(28)16-20)18-25(33)29-24-17-23(27(3,4)5)30-32(24)22-14-9-8-11-19(22)2/h8-14,16-17H,6-7,15,18H2,1-5H3,(H,29,33)