3-methyl-N-[(2S)-3-methyl-1-oxidanylidene-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]butan-2-yl]benzamide

Systemtic Name: 3-methyl-N-[(2S)-3-methyl-1-oxidanylidene-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]butan-2-yl]benzamide Openeye Name: 3-methyl-N-[(1S)-2-methyl-1-[4-[(E)-styryl]sulfonylpiperazine-1-carbonyl]propyl]benzamide CAS Name: 3-methyl-N-[(2S)-3-methyl-1-oxo-1-[4-[(E)-2-phenylethenyl]sulfonyl-1-piperazinyl]butan-2-yl]benzamide IUPAC Name: 3-methyl-N-[(2S)-3-methyl-1-oxo-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]butan-2-yl]benzamide Traditional Name: 3-methyl-N-[(1S)-2-methyl-1-[4-[(E)-styryl]sulfonylpiperazine-1-carbonyl]propyl]benzamide Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N[C@@H](C(C)C)C(=O)N2CCN(CC2)S(=O)(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C25H31N3O4S/c1-19(2)23(26-24(29)22-11-7-8-20(3)18-22)25(30)27-13-15-28(16-14-27)33(31,32)17-12-21-9-5-4-6-10-21/h4-12,17-19,23H,13-16H2,1-3H3,(H,26,29)/b17-12+/t23-/m0/s1