propan-2-yl 7-thia-1,4-diazabicyclo[4.1.0]hepta-3,5-diene-5-carboxylate

Systemtic Name: propan-2-yl 7-thia-1,4-diazabicyclo[4.1.0]hepta-3,5-diene-5-carboxylate Openeye Name: isopropyl 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 propan-2-yl ester IUPAC Name: propan-2-yl 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 isopropyl ester Formula: C8H10N2O2S MolecularWeight: 198.2422

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C2N(S2)CC=N1

Isomeric SMILES

CC(C)OC(=O)C1=C2N(S2)CC=N1

InChI

InChI=1S/C8H10N2O2S/c1-5(2)12-8(11)6-7-10(13-7)4-3-9-6/h3,5H,4H2,1-2H3