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

Systemtic Name: 3-[[(E)-3-(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)prop-2-enoyl]amino]-N,N-diethyl-benzamide Openeye Name: 3-[[(E)-3-(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)prop-2-enoyl]amino]-N,N-diethyl-benzamide CAS Name: 3-[[(E)-3-(1-butyl-5-chloro-3-methyl-4-pyrazolyl)-1-oxoprop-2-enyl]amino]-N,N-diethylbenzamide IUPAC Name: 3-[[(E)-3-(1-butyl-5-chloro-3-methylpyrazol-4-yl)prop-2-enoyl]amino]-N,N-diethylbenzamide Traditional Name: 3-[[(E)-3-(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)acryloyl]amino]-N,N-diethyl-benzamide Formula: C22H29ClN4O2 MolecularWeight: 416.94426

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29ClN4O2/c1-5-8-14-27-21(23)19(16(4)25-27)12-13-20(28)24-18-11-9-10-17(15-18)22(29)26(6-2)7-3/h9-13,15H,5-8,14H2,1-4H3,(H,24,28)/b13-12+