3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-1-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]prop-2-en-1-one

Systemtic Name: 3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-1-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]prop-2-en-1-one Openeye Name: 3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-1-(4-styrylsulfonylpiperazin-1-yl)prop-2-en-1-one CAS Name: 3-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-1-[4-(2-phenylethenylsulfonyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: 3-(3,5-dimethyl-1-phenylpyrazol-4-yl)-1-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]prop-2-en-1-one Traditional Name: 3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-1-(4-styrylsulfonylpiperazino)prop-2-en-1-one Formula: C26H28N4O3S MolecularWeight: 476.59052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C=CC(=O)N3CCN(CC3)S(=O)(=O)C=CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C=CC(=O)N3CCN(CC3)S(=O)(=O)C=CC4=CC=CC=C4

InChI

InChI=1S/C26H28N4O3S/c1-21-25(22(2)30(27-21)24-11-7-4-8-12-24)13-14-26(31)28-16-18-29(19-17-28)34(32,33)20-15-23-9-5-3-6-10-23/h3-15,20H,16-19H2,1-2H3