2-[[(E)-3-[1-(phenylmethyl)-3-pyridin-3-yl-pyrazol-4-yl]prop-2-enoyl]amino]-N-propyl-benzamide

Systemtic Name: 2-[[(E)-3-[1-(phenylmethyl)-3-pyridin-3-yl-pyrazol-4-yl]prop-2-enoyl]amino]-N-propyl-benzamide Openeye Name: 2-[[(E)-3-[1-benzyl-3-(3-pyridyl)pyrazol-4-yl]prop-2-enoyl]amino]-N-propyl-benzamide CAS Name: 2-[[(E)-1-oxo-3-[1-(phenylmethyl)-3-(3-pyridinyl)-4-pyrazolyl]prop-2-enyl]amino]-N-propylbenzamide IUPAC Name: 2-[[(E)-3-(1-benzyl-3-pyridin-3-ylpyrazol-4-yl)prop-2-enoyl]amino]-N-propylbenzamide Traditional Name: 2-[[(E)-3-[1-benzyl-3-(3-pyridyl)pyrazol-4-yl]acryloyl]amino]-N-propyl-benzamide Formula: C28H27N5O2 MolecularWeight: 465.54628

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC=CC=C1NC(=O)C=CC2=CN(N=C2C3=CN=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CCCNC(=O)C1=CC=CC=C1NC(=O)/C=C/C2=CN(N=C2C3=CN=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C28H27N5O2/c1-2-16-30-28(35)24-12-6-7-13-25(24)31-26(34)15-14-23-20-33(19-21-9-4-3-5-10-21)32-27(23)22-11-8-17-29-18-22/h3-15,17-18,20H,2,16,19H2,1H3,(H,30,35)(H,31,34)/b15-14+