4-methyl-N-[(1S)-2-oxidanylidene-2-[4-(phenylcarbonyl)piperazin-1-yl]-1-(phenylsulfonyl)ethyl]benzamide

Systemtic Name: 4-methyl-N-[(1S)-2-oxidanylidene-2-[4-(phenylcarbonyl)piperazin-1-yl]-1-(phenylsulfonyl)ethyl]benzamide Openeye Name: N-[(1S)-1-(benzenesulfonyl)-2-(4-benzoylpiperazin-1-yl)-2-oxo-ethyl]-4-methyl-benzamide CAS Name: N-[(1S)-1-(benzenesulfonyl)-2-(4-benzoyl-1-piperazinyl)-2-oxoethyl]-4-methylbenzamide IUPAC Name: N-[(1S)-1-(benzenesulfonyl)-2-(4-benzoylpiperazin-1-yl)-2-oxoethyl]-4-methylbenzamide Traditional Name: N-[(1S)-2-(4-benzoylpiperazino)-1-besyl-2-keto-ethyl]-4-methyl-benzamide Formula: C27H27N3O5S MolecularWeight: 505.58538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N[C@H](C(=O)N2CCN(CC2)C(=O)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H27N3O5S/c1-20-12-14-21(15-13-20)24(31)28-25(36(34,35)23-10-6-3-7-11-23)27(33)30-18-16-29(17-19-30)26(32)22-8-4-2-5-9-22/h2-15,25H,16-19H2,1H3,(H,28,31)/t25-/m0/s1