(2R)-N-[(2S)-1-azanyl-3-(4-methoxyphenyl)-1-oxidanylidene-propan-2-yl]-1-methylsulfonyl-4-(phenylsulfonyl)piperazine-2-carboxamide

Systemtic Name: (2R)-N-[(2S)-1-azanyl-3-(4-methoxyphenyl)-1-oxidanylidene-propan-2-yl]-1-methylsulfonyl-4-(phenylsulfonyl)piperazine-2-carboxamide Openeye Name: (2R)-N-[(1S)-2-amino-1-[(4-methoxyphenyl)methyl]-2-oxo-ethyl]-4-(benzenesulfonyl)-1-methylsulfonyl-piperazine-2-carboxamide CAS Name: (2R)-N-[(2S)-1-amino-3-(4-methoxyphenyl)-1-oxopropan-2-yl]-4-(benzenesulfonyl)-1-methylsulfonyl-2-piperazinecarboxamide IUPAC Name: (2R)-N-[(2S)-1-amino-3-(4-methoxyphenyl)-1-oxopropan-2-yl]-4-(benzenesulfonyl)-1-methylsulfonylpiperazine-2-carboxamide Traditional Name: (2R)-N-[(1S)-2-amino-2-keto-1-p-anisyl-ethyl]-4-besyl-1-mesyl-piperazine-2-carboxamide Formula: C22H28N4O7S2 MolecularWeight: 524.61032

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(C(=O)N)NC(=O)C2CN(CCN2S(=O)(=O)C)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)C[C@@H](C(=O)N)NC(=O)[C@H]2CN(CCN2S(=O)(=O)C)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H28N4O7S2/c1-33-17-10-8-16(9-11-17)14-19(21(23)27)24-22(28)20-15-25(12-13-26(20)34(2,29)30)35(31,32)18-6-4-3-5-7-18/h3-11,19-20H,12-15H2,1-2H3,(H2,23,27)(H,24,28)/t19-,20+/m0/s1