tert-butyl 2-[(triphenylmethyl)sulfanylmethyl]-4,5,6,7-tetrahydroindole-1-carboxylate

Systemtic Name: tert-butyl 2-[(triphenylmethyl)sulfanylmethyl]-4,5,6,7-tetrahydroindole-1-carboxylate Openeye Name: tert-butyl 2-(tritylsulfanylmethyl)-4,5,6,7-tetrahydroindole-1-carboxylate CAS Name: 2-[[(triphenylmethyl)thio]methyl]-4,5,6,7-tetrahydroindole-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-(tritylsulfanylmethyl)-4,5,6,7-tetrahydroindole-1-carboxylate Traditional Name: 2-[(tritylthio)methyl]-4,5,6,7-tetrahydroindole-1-carboxylic acid tert-butyl ester Formula: C33H35NO2S MolecularWeight: 509.7015

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C2=C(CCCC2)C=C1CSC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC(C)(C)OC(=O)N1C2=C(CCCC2)C=C1CSC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C33H35NO2S/c1-32(2,3)36-31(35)34-29(23-25-15-13-14-22-30(25)34)24-37-33(26-16-7-4-8-17-26,27-18-9-5-10-19-27)28-20-11-6-12-21-28/h4-12,16-21,23H,13-15,22,24H2,1-3H3