N-[(E)-3-oxidanylidene-3-[(phenylmethyl)amino]-1-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)prop-1-en-2-yl]benzamide

Systemtic Name: N-[(E)-3-oxidanylidene-3-[(phenylmethyl)amino]-1-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)prop-1-en-2-yl]benzamide Openeye Name: N-[(E)-1-(benzylcarbamoyl)-2-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]vinyl]benzamide CAS Name: N-[(E)-3-oxo-3-[(phenylmethyl)amino]-1-[1-phenyl-3-(3-pyridinyl)-4-pyrazolyl]prop-1-en-2-yl]benzamide IUPAC Name: N-[(E)-3-(benzylamino)-3-oxo-1-(1-phenyl-3-pyridin-3-ylpyrazol-4-yl)prop-1-en-2-yl]benzamide Traditional Name: N-[(E)-1-(benzylcarbamoyl)-2-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]vinyl]benzamide Formula: C31H25N5O2 MolecularWeight: 499.5625

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C(=CC2=CN(N=C2C3=CN=CC=C3)C4=CC=CC=C4)NC(=O)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)/C(=C\C2=CN(N=C2C3=CN=CC=C3)C4=CC=CC=C4)/NC(=O)C5=CC=CC=C5

InChI

InChI=1S/C31H25N5O2/c37-30(24-13-6-2-7-14-24)34-28(31(38)33-20-23-11-4-1-5-12-23)19-26-22-36(27-16-8-3-9-17-27)35-29(26)25-15-10-18-32-21-25/h1-19,21-22H,20H2,(H,33,38)(H,34,37)/b28-19+