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

Systemtic Name: 3-[[(E)-3-(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)prop-2-enoyl]amino]-N-ethyl-benzamide Openeye Name: 3-[[(E)-3-(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)prop-2-enoyl]amino]-N-ethyl-benzamide CAS Name: 3-[[(E)-3-(1-butyl-5-chloro-3-methyl-4-pyrazolyl)-1-oxoprop-2-enyl]amino]-N-ethylbenzamide IUPAC Name: 3-[[(E)-3-(1-butyl-5-chloro-3-methylpyrazol-4-yl)prop-2-enoyl]amino]-N-ethylbenzamide Traditional Name: 3-[[(E)-3-(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)acryloyl]amino]-N-ethyl-benzamide Formula: C20H25ClN4O2 MolecularWeight: 388.8911

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=N1)C)C=CC(=O)NC2=CC=CC(=C2)C(=O)NCC)Cl

Isomeric SMILES

CCCCN1C(=C(C(=N1)C)/C=C/C(=O)NC2=CC=CC(=C2)C(=O)NCC)Cl

InChI

InChI=1S/C20H25ClN4O2/c1-4-6-12-25-19(21)17(14(3)24-25)10-11-18(26)23-16-9-7-8-15(13-16)20(27)22-5-2/h7-11,13H,4-6,12H2,1-3H3,(H,22,27)(H,23,26)/b11-10+