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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CNC(=O)C1=CN(N=C1C2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)NC(=O)CNC(=O)C1=CN(N=C1C2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C23H26N4O2/c1-23(2,3)25-20(28)14-24-22(29)19-16-27(15-17-10-6-4-7-11-17)26-21(19)18-12-8-5-9-13-18/h4-13,16H,14-15H2,1-3H3,(H,24,29)(H,25,28)