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

Systemtic Name: 2-[[(E)-3-(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)prop-2-enoyl]amino]-N-propyl-benzamide Openeye Name: 2-[[(E)-3-(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)prop-2-enoyl]amino]-N-propyl-benzamide CAS Name: 2-[[(E)-3-(1-butyl-5-chloro-3-methyl-4-pyrazolyl)-1-oxoprop-2-enyl]amino]-N-propylbenzamide IUPAC Name: 2-[[(E)-3-(1-butyl-5-chloro-3-methylpyrazol-4-yl)prop-2-enoyl]amino]-N-propylbenzamide Traditional Name: 2-[[(E)-3-(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)acryloyl]amino]-N-propyl-benzamide Formula: C21H27ClN4O2 MolecularWeight: 402.91768

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=N1)C)C=CC(=O)NC2=CC=CC=C2C(=O)NCCC)Cl

Isomeric SMILES

CCCCN1C(=C(C(=N1)C)/C=C/C(=O)NC2=CC=CC=C2C(=O)NCCC)Cl

InChI

InChI=1S/C21H27ClN4O2/c1-4-6-14-26-20(22)16(15(3)25-26)11-12-19(27)24-18-10-8-7-9-17(18)21(28)23-13-5-2/h7-12H,4-6,13-14H2,1-3H3,(H,23,28)(H,24,27)/b12-11+