N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-3-(2-methylphenyl)-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-3-(2-methylphenyl)-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-[2-(tert-butylamino)-2-oxo-ethyl]-3-(o-tolyl)-1-phenyl-pyrazole-4-carboxamide CAS Name: N-[2-(tert-butylamino)-2-oxoethyl]-3-(2-methylphenyl)-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-[2-(tert-butylamino)-2-oxoethyl]-3-(2-methylphenyl)-1-phenylpyrazole-4-carboxamide Traditional Name: N-[2-(tert-butylamino)-2-keto-ethyl]-3-(o-tolyl)-1-phenyl-pyrazole-4-carboxamide Formula: C23H26N4O2 MolecularWeight: 390.47814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN(C=C2C(=O)NCC(=O)NC(C)(C)C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1C2=NN(C=C2C(=O)NCC(=O)NC(C)(C)C)C3=CC=CC=C3

InChI

InChI=1S/C23H26N4O2/c1-16-10-8-9-13-18(16)21-19(15-27(26-21)17-11-6-5-7-12-17)22(29)24-14-20(28)25-23(2,3)4/h5-13,15H,14H2,1-4H3,(H,24,29)(H,25,28)