N-[2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-1-(phenylmethyl)-3-pyridin-3-yl-pyrazole-4-carboxamide

Systemtic Name: N-[2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-1-(phenylmethyl)-3-pyridin-3-yl-pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-[2-(2,3-dimethylanilino)-2-oxo-ethyl]-3-(3-pyridyl)pyrazole-4-carboxamide CAS Name: N-[2-(2,3-dimethylanilino)-2-oxoethyl]-1-(phenylmethyl)-3-(3-pyridinyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-[2-(2,3-dimethylanilino)-2-oxoethyl]-3-pyridin-3-ylpyrazole-4-carboxamide Traditional Name: 1-benzyl-N-[2-(2,3-dimethylanilino)-2-keto-ethyl]-3-(3-pyridyl)pyrazole-4-carboxamide Formula: C26H25N5O2 MolecularWeight: 439.509

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)CNC(=O)C2=CN(N=C2C3=CN=CC=C3)CC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)CNC(=O)C2=CN(N=C2C3=CN=CC=C3)CC4=CC=CC=C4)C

InChI

InChI=1S/C26H25N5O2/c1-18-8-6-12-23(19(18)2)29-24(32)15-28-26(33)22-17-31(16-20-9-4-3-5-10-20)30-25(22)21-11-7-13-27-14-21/h3-14,17H,15-16H2,1-2H3,(H,28,33)(H,29,32)