tert-butyl N-[4-sulfanylidene-2-[2-[(triphenylmethyl)amino]ethylsulfanyl]-1H-pyrimidin-6-yl]carbamate

Systemtic Name: tert-butyl N-[4-sulfanylidene-2-[2-[(triphenylmethyl)amino]ethylsulfanyl]-1H-pyrimidin-6-yl]carbamate Openeye Name: tert-butyl N-[4-thioxo-2-[2-(tritylamino)ethylsulfanyl]-1H-pyrimidin-6-yl]carbamate CAS Name: N-[4-sulfanylidene-2-[2-[(triphenylmethyl)amino]ethylthio]-1H-pyrimidin-6-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-sulfanylidene-2-[2-(tritylamino)ethylsulfanyl]-1H-pyrimidin-6-yl]carbamate Traditional Name: N-[4-thioxo-2-[2-(tritylamino)ethylthio]-1H-pyrimidin-6-yl]carbamic acid tert-butyl ester Formula: C30H32N4O2S2 MolecularWeight: 544.73068

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC(=S)N=C(N1)SCCNC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC(=S)N=C(N1)SCCNC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C30H32N4O2S2/c1-29(2,3)36-28(35)33-25-21-26(37)34-27(32-25)38-20-19-31-30(22-13-7-4-8-14-22,23-15-9-5-10-16-23)24-17-11-6-12-18-24/h4-18,21,31H,19-20H2,1-3H3,(H2,32,33,34,35,37)