(phenylmethyl) N-[2,3-bis(oxidanyl)propyl]-N-[1-[3-methyl-4-[methyl(phenylsulfonyl)amino]-3-phenyl-butyl]piperidin-4-yl]carbamate

Systemtic Name: (phenylmethyl) N-[2,3-bis(oxidanyl)propyl]-N-[1-[3-methyl-4-[methyl(phenylsulfonyl)amino]-3-phenyl-butyl]piperidin-4-yl]carbamate Openeye Name: benzyl N-[1-[4-[benzenesulfonyl(methyl)amino]-3-methyl-3-phenyl-butyl]-4-piperidyl]-N-(2,3-dihydroxypropyl)carbamate CAS Name: N-[1-[4-[benzenesulfonyl(methyl)amino]-3-methyl-3-phenylbutyl]-4-piperidinyl]-N-(2,3-dihydroxypropyl)carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-[4-[benzenesulfonyl(methyl)amino]-3-methyl-3-phenylbutyl]piperidin-4-yl]-N-(2,3-dihydroxypropyl)carbamate Traditional Name: N-[1-[4-[besyl(methyl)amino]-3-methyl-3-phenyl-butyl]-4-piperidyl]-N-glyceryl-carbamic acid benzyl ester Formula: C34H45N3O6S MolecularWeight: 623.8026

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCN1CCC(CC1)N(CC(CO)O)C(=O)OCC2=CC=CC=C2)(CN(C)S(=O)(=O)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(CCN1CCC(CC1)N(CC(CO)O)C(=O)OCC2=CC=CC=C2)(CN(C)S(=O)(=O)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C34H45N3O6S/c1-34(29-14-8-4-9-15-29,27-35(2)44(41,42)32-16-10-5-11-17-32)20-23-36-21-18-30(19-22-36)37(24-31(39)25-38)33(40)43-26-28-12-6-3-7-13-28/h3-17,30-31,38-39H,18-27H2,1-2H3