tert-butyl N-[2-[3-chloranylpropyl-(triphenylmethyl)sulfanyl-amino]ethyl]carbamate

Systemtic Name: tert-butyl N-[2-[3-chloranylpropyl-(triphenylmethyl)sulfanyl-amino]ethyl]carbamate Openeye Name: tert-butyl N-[2-[3-chloropropyl(tritylsulfanyl)amino]ethyl]carbamate CAS Name: N-[2-[3-chloropropyl-[(triphenylmethyl)thio]amino]ethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-[3-chloropropyl(tritylsulfanyl)amino]ethyl]carbamate Traditional Name: N-[2-[3-chloropropyl-(tritylthio)amino]ethyl]carbamic acid tert-butyl ester Formula: C29H35ClN2O2S MolecularWeight: 511.1184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCN(CCCCl)SC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)NCCN(CCCCl)SC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C29H35ClN2O2S/c1-28(2,3)34-27(33)31-21-23-32(22-13-20-30)35-29(24-14-7-4-8-15-24,25-16-9-5-10-17-25)26-18-11-6-12-19-26/h4-12,14-19H,13,20-23H2,1-3H3,(H,31,33)