(E)-3-(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)-1-[4-(4-ethanoylphenyl)piperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)-1-[4-(4-ethanoylphenyl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-1-[4-(4-acetylphenyl)piperazin-1-yl]-3-(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)prop-2-en-1-one CAS Name: (E)-1-[4-(4-acetylphenyl)-1-piperazinyl]-3-(1-butyl-5-chloro-3-methyl-4-pyrazolyl)-2-propen-1-one IUPAC Name: (E)-1-[4-(4-acetylphenyl)piperazin-1-yl]-3-(1-butyl-5-chloro-3-methylpyrazol-4-yl)prop-2-en-1-one Traditional Name: (E)-1-[4-(4-acetylphenyl)piperazino]-3-(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)prop-2-en-1-one Formula: C23H29ClN4O2 MolecularWeight: 428.95496

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=N1)C)C=CC(=O)N2CCN(CC2)C3=CC=C(C=C3)C(=O)C)Cl

Isomeric SMILES

CCCCN1C(=C(C(=N1)C)/C=C/C(=O)N2CCN(CC2)C3=CC=C(C=C3)C(=O)C)Cl

InChI

InChI=1S/C23H29ClN4O2/c1-4-5-12-28-23(24)21(17(2)25-28)10-11-22(30)27-15-13-26(14-16-27)20-8-6-19(7-9-20)18(3)29/h6-11H,4-5,12-16H2,1-3H3/b11-10+