4-chloranyl-N-[2-[[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]amino]ethyl]benzamide

Systemtic Name: 4-chloranyl-N-[2-[[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]amino]ethyl]benzamide Openeye Name: 4-chloro-N-[2-[[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]amino]ethyl]benzamide CAS Name: 4-chloro-N-[2-[[(E)-1-oxo-3-(1-phenyl-4-pyrazolyl)prop-2-enyl]amino]ethyl]benzamide IUPAC Name: 4-chloro-N-[2-[[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]amino]ethyl]benzamide Traditional Name: 4-chloro-N-[2-[[(E)-3-(1-phenylpyrazol-4-yl)acryloyl]amino]ethyl]benzamide Formula: C21H19ClN4O2 MolecularWeight: 394.85416

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)C=CC(=O)NCCNC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)/C=C/C(=O)NCCNC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H19ClN4O2/c22-18-9-7-17(8-10-18)21(28)24-13-12-23-20(27)11-6-16-14-25-26(15-16)19-4-2-1-3-5-19/h1-11,14-15H,12-13H2,(H,23,27)(H,24,28)/b11-6+