tert-butyl 3,4-bis(sulfanylmethyl)pyrrole-1-carboxylate

Systemtic Name: tert-butyl 3,4-bis(sulfanylmethyl)pyrrole-1-carboxylate Openeye Name: tert-butyl 3,4-bis(sulfanylmethyl)pyrrole-1-carboxylate CAS Name: 3,4-bis(mercaptomethyl)-1-pyrrolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3,4-bis(sulfanylmethyl)pyrrole-1-carboxylate Traditional Name: 3,4-bis(mercaptomethyl)pyrrole-1-carboxylic acid tert-butyl ester Formula: C11H17NO2S2 MolecularWeight: 259.38818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(C(=C1)CS)CS

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(C(=C1)CS)CS

InChI

InChI=1S/C11H17NO2S2/c1-11(2,3)14-10(13)12-4-8(6-15)9(5-12)7-16/h4-5,15-16H,6-7H2,1-3H3