(3,5-dimethylphenyl)-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methanone

Systemtic Name: (3,5-dimethylphenyl)-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methanone Openeye Name: (3,5-dimethylphenyl)-[4-[(E)-styryl]sulfonylpiperazin-1-yl]methanone CAS Name: (3,5-dimethylphenyl)-[4-[(E)-2-phenylethenyl]sulfonyl-1-piperazinyl]methanone IUPAC Name: (3,5-dimethylphenyl)-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methanone Traditional Name: (3,5-dimethylphenyl)-[4-[(E)-styryl]sulfonylpiperazino]methanone Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)N2CCN(CC2)S(=O)(=O)C=CC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)N2CCN(CC2)S(=O)(=O)/C=C/C3=CC=CC=C3)C

InChI

InChI=1S/C21H24N2O3S/c1-17-14-18(2)16-20(15-17)21(24)22-9-11-23(12-10-22)27(25,26)13-8-19-6-4-3-5-7-19/h3-8,13-16H,9-12H2,1-2H3/b13-8+