tert-butyl N-(3-phenacylsulfanyl-4-phenylmethoxy-butyl)-N-(phenylmethyl)carbamate

Systemtic Name: tert-butyl N-(3-phenacylsulfanyl-4-phenylmethoxy-butyl)-N-(phenylmethyl)carbamate Openeye Name: tert-butyl N-benzyl-N-(4-benzyloxy-3-phenacylsulfanyl-butyl)carbamate CAS Name: N-[3-(phenacylthio)-4-phenylmethoxybutyl]-N-(phenylmethyl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-benzyl-N-(3-phenacylsulfanyl-4-phenylmethoxybutyl)carbamate Traditional Name: N-[4-benzoxy-3-(phenacylthio)butyl]-N-benzyl-carbamic acid tert-butyl ester Formula: C31H37NO4S MolecularWeight: 519.69478

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CCC(COCC1=CC=CC=C1)SCC(=O)C2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N(CCC(COCC1=CC=CC=C1)SCC(=O)C2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C31H37NO4S/c1-31(2,3)36-30(34)32(21-25-13-7-4-8-14-25)20-19-28(23-35-22-26-15-9-5-10-16-26)37-24-29(33)27-17-11-6-12-18-27/h4-18,28H,19-24H2,1-3H3