4-[(E)-3-[5-chloranyl-3-methyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]prop-2-enoyl]piperazin-2-one

Systemtic Name: 4-[(E)-3-[5-chloranyl-3-methyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]prop-2-enoyl]piperazin-2-one Openeye Name: 4-[(E)-3-[5-chloro-3-methyl-1-(p-tolylmethyl)pyrazol-4-yl]prop-2-enoyl]piperazin-2-one CAS Name: 4-[(E)-3-[5-chloro-3-methyl-1-[(4-methylphenyl)methyl]-4-pyrazolyl]-1-oxoprop-2-enyl]-2-piperazinone IUPAC Name: 4-[(E)-3-[5-chloro-3-methyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]prop-2-enoyl]piperazin-2-one Traditional Name: 4-[(E)-3-[5-chloro-3-methyl-1-(4-methylbenzyl)pyrazol-4-yl]acryloyl]piperazin-2-one Formula: C19H21ClN4O2 MolecularWeight: 372.84864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C=CC(=O)N3CCNC(=O)C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)/C=C/C(=O)N3CCNC(=O)C3)Cl

InChI

InChI=1S/C19H21ClN4O2/c1-13-3-5-15(6-4-13)11-24-19(20)16(14(2)22-24)7-8-18(26)23-10-9-21-17(25)12-23/h3-8H,9-12H2,1-2H3,(H,21,25)/b8-7+