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

Systemtic Name: pyridin-3-ylmethyl N-[4-[(4-acetamidophenyl)sulfonyl-(cyclopentylmethyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamate Openeye Name: 3-pyridylmethyl N-[3-[(4-acetamidophenyl)sulfonyl-(cyclopentylmethyl)amino]-1-benzyl-2-hydroxy-propyl]carbamate CAS Name: N-[4-[(4-acetamidophenyl)sulfonyl-(cyclopentylmethyl)amino]-3-hydroxy-1-phenylbutan-2-yl]carbamic acid 3-pyridinylmethyl ester IUPAC Name: pyridin-3-ylmethyl N-[4-[(4-acetamidophenyl)sulfonyl-(cyclopentylmethyl)amino]-3-hydroxy-1-phenylbutan-2-yl]carbamate Traditional Name: N-[3-[(4-acetamidophenyl)sulfonyl-(cyclopentylmethyl)amino]-1-benzyl-2-hydroxy-propyl]carbamic acid 3-pyridylmethyl ester Formula: C31H38N4O6S MolecularWeight: 594.72162

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N(CC2CCCC2)CC(C(CC3=CC=CC=C3)NC(=O)OCC4=CN=CC=C4)O

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N(CC2CCCC2)CC(C(CC3=CC=CC=C3)NC(=O)OCC4=CN=CC=C4)O

InChI

InChI=1S/C31H38N4O6S/c1-23(36)33-27-13-15-28(16-14-27)42(39,40)35(20-25-10-5-6-11-25)21-30(37)29(18-24-8-3-2-4-9-24)34-31(38)41-22-26-12-7-17-32-19-26/h2-4,7-9,12-17,19,25,29-30,37H,5-6,10-11,18,20-22H2,1H3,(H,33,36)(H,34,38)