tert-butyl carbamate; 3-[[2-(ethylsulfanylmethyl)phenyl]-diphenyl-methyl]sulfanylpyridine

Systemtic Name: tert-butyl carbamate; 3-[[2-(ethylsulfanylmethyl)phenyl]-diphenyl-methyl]sulfanylpyridine Openeye Name: tert-butyl carbamate; 3-[[2-(ethylsulfanylmethyl)phenyl]-diphenyl-methyl]sulfanylpyridine CAS Name: carbamic acid tert-butyl ester; 3-[[[2-[(ethylthio)methyl]phenyl]-diphenylmethyl]thio]pyridine IUPAC Name: tert-butyl carbamate; 3-[[2-(ethylsulfanylmethyl)phenyl]-diphenylmethyl]sulfanylpyridine Traditional Name: carbamic acid tert-butyl ester; 3-[[[2-[(ethylthio)methyl]phenyl]-diphenyl-methyl]thio]pyridine Formula: C32H36N2O2S2 MolecularWeight: 544.77044

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Descriptors Computed from Structure

Canonical SMILES:

CCSCC1=CC=CC=C1C(C2=CC=CC=C2)(C3=CC=CC=C3)SC4=CN=CC=C4.CC(C)(C)OC(=O)N

Isomeric SMILES

CCSCC1=CC=CC=C1C(C2=CC=CC=C2)(C3=CC=CC=C3)SC4=CN=CC=C4.CC(C)(C)OC(=O)N

InChI

InChI=1S/C27H25NS2.C5H11NO2/c1-2-29-21-22-12-9-10-18-26(22)27(23-13-5-3-6-14-23,24-15-7-4-8-16-24)30-25-17-11-19-28-20-25;1-5(2,3)8-4(6)7/h3-20H,2,21H2,1H3;1-3H3,(H2,6,7)