(E)-N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-3-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)prop-2-enamide

Systemtic Name: (E)-N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-3-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)prop-2-enamide Openeye Name: (E)-N-[2-(tert-butylamino)-2-oxo-ethyl]-3-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]prop-2-enamide CAS Name: (E)-N-[2-(tert-butylamino)-2-oxoethyl]-3-[1-phenyl-3-(3-pyridinyl)-4-pyrazolyl]-2-propenamide IUPAC Name: (E)-N-[2-(tert-butylamino)-2-oxoethyl]-3-(1-phenyl-3-pyridin-3-ylpyrazol-4-yl)prop-2-enamide Traditional Name: (E)-N-[2-(tert-butylamino)-2-keto-ethyl]-3-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]acrylamide Formula: C23H25N5O2 MolecularWeight: 403.4769

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CNC(=O)C=CC1=CN(N=C1C2=CN=CC=C2)C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C23H25N5O2/c1-23(2,3)26-21(30)15-25-20(29)12-11-18-16-28(19-9-5-4-6-10-19)27-22(18)17-8-7-13-24-14-17/h4-14,16H,15H2,1-3H3,(H,25,29)(H,26,30)/b12-11+