tert-butyl N-[4-[2-methylpropyl-[(2-methylsulfanyl-1,3-benzoxazol-6-yl)sulfonyl]amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[4-[2-methylpropyl-[(2-methylsulfanyl-1,3-benzoxazol-6-yl)sulfonyl]amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamate Openeye Name: tert-butyl N-[1-benzyl-2-hydroxy-3-[isobutyl-[(2-methylsulfanyl-1,3-benzoxazol-6-yl)sulfonyl]amino]propyl]carbamate CAS Name: N-[3-hydroxy-4-[2-methylpropyl-[[2-(methylthio)-1,3-benzoxazol-6-yl]sulfonyl]amino]-1-phenylbutan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-hydroxy-4-[2-methylpropyl-[(2-methylsulfanyl-1,3-benzoxazol-6-yl)sulfonyl]amino]-1-phenylbutan-2-yl]carbamate Traditional Name: N-[1-benzyl-2-hydroxy-3-[isobutyl-[[2-(methylthio)-1,3-benzoxazol-6-yl]sulfonyl]amino]propyl]carbamic acid tert-butyl ester Formula: C27H37N3O6S2 MolecularWeight: 563.72918

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C(CC1=CC=CC=C1)NC(=O)OC(C)(C)C)O)S(=O)(=O)C2=CC3=C(C=C2)N=C(O3)SC

Isomeric SMILES

CC(C)CN(CC(C(CC1=CC=CC=C1)NC(=O)OC(C)(C)C)O)S(=O)(=O)C2=CC3=C(C=C2)N=C(O3)SC

InChI

InChI=1S/C27H37N3O6S2/c1-18(2)16-30(38(33,34)20-12-13-21-24(15-20)35-26(29-21)37-6)17-23(31)22(14-19-10-8-7-9-11-19)28-25(32)36-27(3,4)5/h7-13,15,18,22-23,31H,14,16-17H2,1-6H3,(H,28,32)