pyridin-3-ylmethyl N-[4-[(4-acetamidophenyl)sulfonyl-(2-methylpropyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamate

Systemtic Name: pyridin-3-ylmethyl N-[4-[(4-acetamidophenyl)sulfonyl-(2-methylpropyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamate Openeye Name: 3-pyridylmethyl N-[3-[(4-acetamidophenyl)sulfonyl-isobutyl-amino]-1-benzyl-2-hydroxy-propyl]carbamate CAS Name: N-[4-[(4-acetamidophenyl)sulfonyl-(2-methylpropyl)amino]-3-hydroxy-1-phenylbutan-2-yl]carbamic acid 3-pyridinylmethyl ester IUPAC Name: pyridin-3-ylmethyl N-[4-[(4-acetamidophenyl)sulfonyl-(2-methylpropyl)amino]-3-hydroxy-1-phenylbutan-2-yl]carbamate Traditional Name: N-[3-[(4-acetamidophenyl)sulfonyl-isobutyl-amino]-1-benzyl-2-hydroxy-propyl]carbamic acid 3-pyridylmethyl ester Formula: C29H36N4O6S MolecularWeight: 568.68434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C(CC1=CC=CC=C1)NC(=O)OCC2=CN=CC=C2)O)S(=O)(=O)C3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CC(C)CN(CC(C(CC1=CC=CC=C1)NC(=O)OCC2=CN=CC=C2)O)S(=O)(=O)C3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C29H36N4O6S/c1-21(2)18-33(40(37,38)26-13-11-25(12-14-26)31-22(3)34)19-28(35)27(16-23-8-5-4-6-9-23)32-29(36)39-20-24-10-7-15-30-17-24/h4-15,17,21,27-28,35H,16,18-20H2,1-3H3,(H,31,34)(H,32,36)