tert-butyl N-[1-(2-chlorophenyl)-1-dimethoxyphosphoryloxy-2-methyl-4-(3-phenylmethoxyphenyl)sulfanyl-butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-(2-chlorophenyl)-1-dimethoxyphosphoryloxy-2-methyl-4-(3-phenylmethoxyphenyl)sulfanyl-butan-2-yl]carbamate Openeye Name: tert-butyl N-[3-(3-benzyloxyphenyl)sulfanyl-1-[(2-chlorophenyl)-dimethoxyphosphoryloxy-methyl]-1-methyl-propyl]carbamate CAS Name: N-[1-(2-chlorophenyl)-1-dimethoxyphosphoryloxy-2-methyl-4-[(3-phenylmethoxyphenyl)thio]butan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-(2-chlorophenyl)-1-dimethoxyphosphoryloxy-2-methyl-4-(3-phenylmethoxyphenyl)sulfanylbutan-2-yl]carbamate Traditional Name: N-[3-[(3-benzoxyphenyl)thio]-1-[(2-chlorophenyl)-dimethoxyphosphoryloxy-methyl]-1-methyl-propyl]carbamic acid tert-butyl ester Formula: C31H39ClNO7PS MolecularWeight: 636.135621

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(C)(CCSC1=CC=CC(=C1)OCC2=CC=CC=C2)C(C3=CC=CC=C3Cl)OP(=O)(OC)OC

Isomeric SMILES

CC(C)(C)OC(=O)NC(C)(CCSC1=CC=CC(=C1)OCC2=CC=CC=C2)C(C3=CC=CC=C3Cl)OP(=O)(OC)OC

InChI

InChI=1S/C31H39ClNO7PS/c1-30(2,3)39-29(34)33-31(4,28(40-41(35,36-5)37-6)26-17-10-11-18-27(26)32)19-20-42-25-16-12-15-24(21-25)38-22-23-13-8-7-9-14-23/h7-18,21,28H,19-20,22H2,1-6H3,(H,33,34)