N-[2-methyl-5-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]carbonyl-phenyl]benzamide

Systemtic Name: N-[2-methyl-5-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]carbonyl-phenyl]benzamide Openeye Name: N-[2-methyl-5-[4-[(E)-styryl]sulfonylpiperazine-1-carbonyl]phenyl]benzamide CAS Name: N-[2-methyl-5-[oxo-[4-[(E)-2-phenylethenyl]sulfonyl-1-piperazinyl]methyl]phenyl]benzamide IUPAC Name: N-[2-methyl-5-[4-[(E)-2-phenylethenyl]sulfonylpiperazine-1-carbonyl]phenyl]benzamide Traditional Name: N-[2-methyl-5-[4-[(E)-styryl]sulfonylpiperazine-1-carbonyl]phenyl]benzamide Formula: C27H27N3O4S MolecularWeight: 489.58598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C=CC3=CC=CC=C3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)/C=C/C3=CC=CC=C3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H27N3O4S/c1-21-12-13-24(20-25(21)28-26(31)23-10-6-3-7-11-23)27(32)29-15-17-30(18-16-29)35(33,34)19-14-22-8-4-2-5-9-22/h2-14,19-20H,15-18H2,1H3,(H,28,31)/b19-14+