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

Systemtic Name: tert-butyl N-[1-[(3-chlorophenyl)amino]-3-(triphenylmethyl)sulfanyl-propan-2-yl]carbamate Openeye Name: tert-butyl N-[1-[(3-chloroanilino)methyl]-2-tritylsulfanyl-ethyl]carbamate CAS Name: N-[1-(3-chloroanilino)-3-[(triphenylmethyl)thio]propan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-(3-chloroanilino)-3-tritylsulfanylpropan-2-yl]carbamate Traditional Name: N-[1-[(3-chloroanilino)methyl]-2-(tritylthio)ethyl]carbamic acid tert-butyl ester Formula: C33H35ClN2O2S MolecularWeight: 559.1612

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CNC1=CC(=CC=C1)Cl)CSC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)NC(CNC1=CC(=CC=C1)Cl)CSC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C33H35ClN2O2S/c1-32(2,3)38-31(37)36-30(23-35-29-21-13-20-28(34)22-29)24-39-33(25-14-7-4-8-15-25,26-16-9-5-10-17-26)27-18-11-6-12-19-27/h4-22,30,35H,23-24H2,1-3H3,(H,36,37)