tert-butyl N-[1-azanyl-3-(triphenylmethyl)sulfanyl-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-azanyl-3-(triphenylmethyl)sulfanyl-propan-2-yl]carbamate Openeye Name: tert-butyl N-[1-(aminomethyl)-2-tritylsulfanyl-ethyl]carbamate CAS Name: N-[1-amino-3-[(triphenylmethyl)thio]propan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(1-amino-3-tritylsulfanylpropan-2-yl)carbamate Traditional Name: N-[1-(aminomethyl)-2-(tritylthio)ethyl]carbamic acid tert-butyl ester Formula: C27H32N2O2S MolecularWeight: 448.62018

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CN)CSC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)NC(CN)CSC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C27H32N2O2S/c1-26(2,3)31-25(30)29-24(19-28)20-32-27(21-13-7-4-8-14-21,22-15-9-5-10-16-22)23-17-11-6-12-18-23/h4-18,24H,19-20,28H2,1-3H3,(H,29,30)