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

Systemtic Name: N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-3-(3,4-dimethylphenyl)-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-[2-(tert-butylamino)-2-oxo-ethyl]-3-(3,4-dimethylphenyl)pyrazole-4-carboxamide CAS Name: N-[2-(tert-butylamino)-2-oxoethyl]-3-(3,4-dimethylphenyl)-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-[2-(tert-butylamino)-2-oxoethyl]-3-(3,4-dimethylphenyl)pyrazole-4-carboxamide Traditional Name: 1-benzyl-N-[2-(tert-butylamino)-2-keto-ethyl]-3-(3,4-dimethylphenyl)pyrazole-4-carboxamide Formula: C25H30N4O2 MolecularWeight: 418.5313

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C=C2C(=O)NCC(=O)NC(C)(C)C)CC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C=C2C(=O)NCC(=O)NC(C)(C)C)CC3=CC=CC=C3)C

InChI

InChI=1S/C25H30N4O2/c1-17-11-12-20(13-18(17)2)23-21(24(31)26-14-22(30)27-25(3,4)5)16-29(28-23)15-19-9-7-6-8-10-19/h6-13,16H,14-15H2,1-5H3,(H,26,31)(H,27,30)