oxolan-3-yl N-[4-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]-1-phenyl-3-sulfooxy-butan-2-yl]carbamate

Systemtic Name: oxolan-3-yl N-[4-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]-1-phenyl-3-sulfooxy-butan-2-yl]carbamate Openeye Name: tetrahydrofuran-3-yl N-[3-[(4-aminophenyl)sulfonyl-isobutyl-amino]-1-benzyl-2-sulfooxy-propyl]carbamate CAS Name: N-[4-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]-1-phenyl-3-sulfooxybutan-2-yl]carbamic acid 3-oxolanyl ester IUPAC Name: oxolan-3-yl N-[4-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]-1-phenyl-3-sulfooxybutan-2-yl]carbamate Traditional Name: N-[1-benzyl-3-[isobutyl(sulfanilyl)amino]-2-sulfoxy-propyl]carbamic acid tetrahydrofuran-3-yl ester Formula: C25H35N3O9S2 MolecularWeight: 585.6901

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C(CC1=CC=CC=C1)NC(=O)OC2CCOC2)OS(=O)(=O)O)S(=O)(=O)C3=CC=C(C=C3)N

Isomeric SMILES

CC(C)CN(CC(C(CC1=CC=CC=C1)NC(=O)OC2CCOC2)OS(=O)(=O)O)S(=O)(=O)C3=CC=C(C=C3)N

InChI

InChI=1S/C25H35N3O9S2/c1-18(2)15-28(38(30,31)22-10-8-20(26)9-11-22)16-24(37-39(32,33)34)23(14-19-6-4-3-5-7-19)27-25(29)36-21-12-13-35-17-21/h3-11,18,21,23-24H,12-17,26H2,1-2H3,(H,27,29)(H,32,33,34)