oxolan-3-yl N-[2-azanyl-8-cyano-3-(4-methoxyphenyl)-3-oxidanyl-1-phenyl-4-sulfonyl-octan-2-yl]carbamate

Systemtic Name: oxolan-3-yl N-[2-azanyl-8-cyano-3-(4-methoxyphenyl)-3-oxidanyl-1-phenyl-4-sulfonyl-octan-2-yl]carbamate Openeye Name: tetrahydrofuran-3-yl N-[1-amino-1-benzyl-7-cyano-2-hydroxy-2-(4-methoxyphenyl)-3-sulfonyl-heptyl]carbamate CAS Name: N-[2-amino-8-cyano-3-hydroxy-3-(4-methoxyphenyl)-1-phenyl-4-sulfonyloctan-2-yl]carbamic acid 3-oxolanyl ester IUPAC Name: oxolan-3-yl N-[2-amino-8-cyano-3-hydroxy-3-(4-methoxyphenyl)-1-phenyl-4-sulfonyloctan-2-yl]carbamate Traditional Name: N-[1-amino-1-benzyl-7-cyano-2-hydroxy-2-(4-methoxyphenyl)-3-sulfonyl-heptyl]carbamic acid tetrahydrofuran-3-yl ester Formula: C27H33N3O7S MolecularWeight: 543.63182

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C(=S(=O)=O)CCCCC#N)(C(CC2=CC=CC=C2)(N)NC(=O)OC3CCOC3)O

Isomeric SMILES

COC1=CC=C(C=C1)C(C(=S(=O)=O)CCCCC#N)(C(CC2=CC=CC=C2)(N)NC(=O)OC3CCOC3)O

InChI

InChI=1S/C27H33N3O7S/c1-35-22-13-11-21(12-14-22)27(32,24(38(33)34)10-6-3-7-16-28)26(29,18-20-8-4-2-5-9-20)30-25(31)37-23-15-17-36-19-23/h2,4-5,8-9,11-14,23,32H,3,6-7,10,15,17-19,29H2,1H3,(H,30,31)