(2S)-N-(2-ethoxyphenyl)-2-phenyl-2-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: (2S)-N-(2-ethoxyphenyl)-2-phenyl-2-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: (2S)-2-(4-benzylsulfonylpiperazin-1-yl)-N-(2-ethoxyphenyl)-2-phenyl-acetamide CAS Name: (2S)-N-(2-ethoxyphenyl)-2-phenyl-2-[4-(phenylmethyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: (2S)-2-(4-benzylsulfonylpiperazin-1-yl)-N-(2-ethoxyphenyl)-2-phenylacetamide Traditional Name: (2S)-2-(4-benzylsulfonylpiperazino)-N-o-phenetyl-2-phenyl-acetamide Formula: C27H31N3O4S MolecularWeight: 493.61774

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C(C2=CC=CC=C2)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)[C@H](C2=CC=CC=C2)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C27H31N3O4S/c1-2-34-25-16-10-9-15-24(25)28-27(31)26(23-13-7-4-8-14-23)29-17-19-30(20-18-29)35(32,33)21-22-11-5-3-6-12-22/h3-16,26H,2,17-21H2,1H3,(H,28,31)/t26-/m0/s1