tert-butyl N-[4-[(4-cyano-2-ethyl-butyl)-(4-methoxyphenyl)sulfonyl-amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[4-[(4-cyano-2-ethyl-butyl)-(4-methoxyphenyl)sulfonyl-amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamate Openeye Name: tert-butyl N-[1-benzyl-3-[(4-cyano-2-ethyl-butyl)-(4-methoxyphenyl)sulfonyl-amino]-2-hydroxy-propyl]carbamate CAS Name: N-[4-[(4-cyano-2-ethylbutyl)-(4-methoxyphenyl)sulfonylamino]-3-hydroxy-1-phenylbutan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[(4-cyano-2-ethylbutyl)-(4-methoxyphenyl)sulfonylamino]-3-hydroxy-1-phenylbutan-2-yl]carbamate Traditional Name: N-[1-benzyl-3-[(4-cyano-2-ethyl-butyl)-(4-methoxyphenyl)sulfonyl-amino]-2-hydroxy-propyl]carbamic acid tert-butyl ester Formula: C29H41N3O6S MolecularWeight: 559.71734

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC#N)CN(CC(C(CC1=CC=CC=C1)NC(=O)OC(C)(C)C)O)S(=O)(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CCC(CCC#N)CN(CC(C(CC1=CC=CC=C1)NC(=O)OC(C)(C)C)O)S(=O)(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C29H41N3O6S/c1-6-22(13-10-18-30)20-32(39(35,36)25-16-14-24(37-5)15-17-25)21-27(33)26(19-23-11-8-7-9-12-23)31-28(34)38-29(2,3)4/h7-9,11-12,14-17,22,26-27,33H,6,10,13,19-21H2,1-5H3,(H,31,34)