methyl 2-[[1-methylsulfonyl-4-(phenylmethyl)piperazin-2-yl]carbonylamino]ethanoate

Systemtic Name: methyl 2-[[1-methylsulfonyl-4-(phenylmethyl)piperazin-2-yl]carbonylamino]ethanoate Openeye Name: methyl 2-[(4-benzyl-1-methylsulfonyl-piperazine-2-carbonyl)amino]acetate CAS Name: 2-[[[1-methylsulfonyl-4-(phenylmethyl)-2-piperazinyl]-oxomethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[(4-benzyl-1-methylsulfonylpiperazine-2-carbonyl)amino]acetate Traditional Name: 2-[(4-benzyl-1-mesyl-piperazine-2-carbonyl)amino]acetic acid methyl ester Formula: C16H23N3O5S MolecularWeight: 369.43592

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)C1CN(CCN1S(=O)(=O)C)CC2=CC=CC=C2

Isomeric SMILES

COC(=O)CNC(=O)C1CN(CCN1S(=O)(=O)C)CC2=CC=CC=C2

InChI

InChI=1S/C16H23N3O5S/c1-24-15(20)10-17-16(21)14-12-18(8-9-19(14)25(2,22)23)11-13-6-4-3-5-7-13/h3-7,14H,8-12H2,1-2H3,(H,17,21)