2-[[(E)-3-phenylprop-2-enoyl]amino]-N-[(1-phenylpyrazol-4-yl)methyl]propanamide

Systemtic Name: 2-[[(E)-3-phenylprop-2-enoyl]amino]-N-[(1-phenylpyrazol-4-yl)methyl]propanamide Openeye Name: 2-[[(E)-3-phenylprop-2-enoyl]amino]-N-[(1-phenylpyrazol-4-yl)methyl]propanamide CAS Name: 2-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]-N-[(1-phenyl-4-pyrazolyl)methyl]propanamide IUPAC Name: 2-[[(E)-3-phenylprop-2-enoyl]amino]-N-[(1-phenylpyrazol-4-yl)methyl]propanamide Traditional Name: 2-[[(E)-3-phenylacryloyl]amino]-N-[(1-phenylpyrazol-4-yl)methyl]propionamide Formula: C22H22N4O2 MolecularWeight: 374.43568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CN(N=C1)C2=CC=CC=C2)NC(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NCC1=CN(N=C1)C2=CC=CC=C2)NC(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C22H22N4O2/c1-17(25-21(27)13-12-18-8-4-2-5-9-18)22(28)23-14-19-15-24-26(16-19)20-10-6-3-7-11-20/h2-13,15-17H,14H2,1H3,(H,23,28)(H,25,27)/b13-12+