N-(2,6-dimethylphenyl)-2-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]propanamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]propanamide Openeye Name: N-(2,6-dimethylphenyl)-2-[4-[(E)-styryl]sulfonylpiperazin-1-yl]propanamide CAS Name: N-(2,6-dimethylphenyl)-2-[4-[(E)-2-phenylethenyl]sulfonyl-1-piperazinyl]propanamide IUPAC Name: N-(2,6-dimethylphenyl)-2-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]propanamide Traditional Name: N-(2,6-dimethylphenyl)-2-[4-[(E)-styryl]sulfonylpiperazino]propionamide Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29N3O3S/c1-18-8-7-9-19(2)22(18)24-23(27)20(3)25-13-15-26(16-14-25)30(28,29)17-12-21-10-5-4-6-11-21/h4-12,17,20H,13-16H2,1-3H3,(H,24,27)/b17-12+