tert-butyl N-(3-oxidanyl-4,4,4-triphenyl-1-sulfanyl-butan-2-yl)carbamate

Systemtic Name: tert-butyl N-(3-oxidanyl-4,4,4-triphenyl-1-sulfanyl-butan-2-yl)carbamate Openeye Name: tert-butyl N-[2-hydroxy-3,3,3-triphenyl-1-(sulfanylmethyl)propyl]carbamate CAS Name: N-(3-hydroxy-1-mercapto-4,4,4-triphenylbutan-2-yl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(3-hydroxy-4,4,4-triphenyl-1-sulfanylbutan-2-yl)carbamate Traditional Name: N-[2-hydroxy-1-(mercaptomethyl)-3,3,3-triphenyl-propyl]carbamic acid tert-butyl ester Formula: C27H31NO3S MolecularWeight: 449.60494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CS)C(C(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CS)C(C(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)O

InChI

InChI=1S/C27H31NO3S/c1-26(2,3)31-25(30)28-23(19-32)24(29)27(20-13-7-4-8-14-20,21-15-9-5-10-16-21)22-17-11-6-12-18-22/h4-18,23-24,29,32H,19H2,1-3H3,(H,28,30)