2-[[(E)-3-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)prop-2-enoyl]amino]benzamide

Systemtic Name: 2-[[(E)-3-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)prop-2-enoyl]amino]benzamide Openeye Name: 2-[[(E)-3-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)prop-2-enoyl]amino]benzamide CAS Name: 2-[[(E)-3-(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)-1-oxoprop-2-enyl]amino]benzamide IUPAC Name: 2-[[(E)-3-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)prop-2-enoyl]amino]benzamide Traditional Name: 2-[[(E)-3-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)acryloyl]amino]benzamide Formula: C20H17ClN4O2 MolecularWeight: 380.82758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)NC2=CC=CC=C2C(=O)N)Cl)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1/C=C/C(=O)NC2=CC=CC=C2C(=O)N)Cl)C3=CC=CC=C3

InChI

InChI=1S/C20H17ClN4O2/c1-13-15(19(21)25(24-13)14-7-3-2-4-8-14)11-12-18(26)23-17-10-6-5-9-16(17)20(22)27/h2-12H,1H3,(H2,22,27)(H,23,26)/b12-11+