N-[(2S,3R)-4-[(4-methoxyphenyl)sulfonyl-(3-methylbutyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamate

Systemtic Name: N-[(2S,3R)-4-[(4-methoxyphenyl)sulfonyl-(3-methylbutyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamate Openeye Name: N-[(1S,2R)-1-benzyl-2-hydroxy-3-[isopentyl-(4-methoxyphenyl)sulfonyl-amino]propyl]carbamate CAS Name: N-[(2S,3R)-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(3-methylbutyl)amino]-1-phenylbutan-2-yl]carbamate IUPAC Name: N-[(2S,3R)-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(3-methylbutyl)amino]-1-phenylbutan-2-yl]carbamate Traditional Name: N-[(1S,2R)-1-benzyl-2-hydroxy-3-[isoamyl-(4-methoxyphenyl)sulfonyl-amino]propyl]carbamate Formula: C23H31N2O6S- MolecularWeight: 463.56704

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(CC(C(CC1=CC=CC=C1)NC(=O)[O-])O)S(=O)(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)CCN(C[C@H]([C@H](CC1=CC=CC=C1)NC(=O)[O-])O)S(=O)(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C23H32N2O6S/c1-17(2)13-14-25(32(29,30)20-11-9-19(31-3)10-12-20)16-22(26)21(24-23(27)28)15-18-7-5-4-6-8-18/h4-12,17,21-22,24,26H,13-16H2,1-3H3,(H,27,28)/p-1/t21-,22+/m0/s1