2-tert-butyl-5-(nitromethylsulfanyl)thiophene

Systemtic Name: 2-tert-butyl-5-(nitromethylsulfanyl)thiophene Openeye Name: 2-tert-butyl-5-(nitromethylsulfanyl)thiophene CAS Name: 2-tert-butyl-5-(nitromethylthio)thiophene IUPAC Name: 2-tert-butyl-5-(nitromethylsulfanyl)thiophene Traditional Name: 2-tert-butyl-5-(nitromethylthio)thiophene Formula: C9H13NO2S2 MolecularWeight: 231.33502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(S1)SC[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(S1)SC[N+](=O)[O-]

InChI

InChI=1S/C9H13NO2S2/c1-9(2,3)7-4-5-8(14-7)13-6-10(11)12/h4-5H,6H2,1-3H3