oxolan-3-yl N-[2-azanyl-8-cyano-3-(4-methoxyphenyl)-6,6-dimethyl-3-oxidanyl-1-phenyl-4-sulfonyl-octan-2-yl]carbamate

Systemtic Name: oxolan-3-yl N-[2-azanyl-8-cyano-3-(4-methoxyphenyl)-6,6-dimethyl-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)-5,5-dimethyl-3-sulfonyl-heptyl]carbamate CAS Name: N-[2-amino-8-cyano-3-hydroxy-3-(4-methoxyphenyl)-6,6-dimethyl-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)-6,6-dimethyl-1-phenyl-4-sulfonyloctan-2-yl]carbamate Traditional Name: N-[1-amino-1-benzyl-7-cyano-2-hydroxy-2-(4-methoxyphenyl)-5,5-dimethyl-3-sulfonyl-heptyl]carbamic acid tetrahydrofuran-3-yl ester Formula: C29H37N3O7S MolecularWeight: 571.68498

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCC#N)CC(=S(=O)=O)C(C1=CC=C(C=C1)OC)(C(CC2=CC=CC=C2)(N)NC(=O)OC3CCOC3)O

Isomeric SMILES

CC(C)(CCC#N)CC(=S(=O)=O)C(C1=CC=C(C=C1)OC)(C(CC2=CC=CC=C2)(N)NC(=O)OC3CCOC3)O

InChI

InChI=1S/C29H37N3O7S/c1-27(2,15-7-16-30)19-25(40(35)36)29(34,22-10-12-23(37-3)13-11-22)28(31,18-21-8-5-4-6-9-21)32-26(33)39-24-14-17-38-20-24/h4-6,8-13,24,34H,7,14-15,17-20,31H2,1-3H3,(H,32,33)