ethyl 7-thia-1,4-diazabicyclo[4.1.0]hepta-3,5-diene-5-carboxylate

Systemtic Name: ethyl 7-thia-1,4-diazabicyclo[4.1.0]hepta-3,5-diene-5-carboxylate Openeye Name: ethyl 7-thia-1,4-diazabicyclo[4.1.0]hepta-3,5-diene-5-carboxylate CAS Name: 7-thia-1,4-diazabicyclo[4.1.0]hepta-3,5-diene-5-carboxylic acid ethyl ester IUPAC Name: ethyl 7-thia-1,4-diazabicyclo[4.1.0]hepta-3,5-diene-5-carboxylate Traditional Name: 7-thia-1,4-diazabicyclo[4.1.0]hepta-3,5-diene-5-carboxylic acid ethyl ester Formula: C7H8N2O2S MolecularWeight: 184.21562

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2N(S2)CC=N1

Isomeric SMILES

CCOC(=O)C1=C2N(S2)CC=N1

InChI

InChI=1S/C7H8N2O2S/c1-2-11-7(10)5-6-9(12-6)4-3-8-5/h3H,2,4H2,1H3