3-[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)prop-2-en-1-one

Systemtic Name: 3-[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)prop-2-en-1-one Openeye Name: 3-[3,5-dimethyl-1-(p-tolylmethyl)pyrazol-4-yl]-1-[4-(2-thienylsulfonyl)piperazin-1-yl]prop-2-en-1-one CAS Name: 3-[3,5-dimethyl-1-[(4-methylphenyl)methyl]-4-pyrazolyl]-1-(4-thiophen-2-ylsulfonyl-1-piperazinyl)-2-propen-1-one IUPAC Name: 3-[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)prop-2-en-1-one Traditional Name: 3-[3,5-dimethyl-1-(4-methylbenzyl)pyrazol-4-yl]-1-[4-(2-thienylsulfonyl)piperazino]prop-2-en-1-one Formula: C24H28N4O3S2 MolecularWeight: 484.63412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C=CC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CS4)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C=CC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CS4)C

InChI

InChI=1S/C24H28N4O3S2/c1-18-6-8-21(9-7-18)17-28-20(3)22(19(2)25-28)10-11-23(29)26-12-14-27(15-13-26)33(30,31)24-5-4-16-32-24/h4-11,16H,12-15,17H2,1-3H3