7-methoxy-N-(1H-1,2,4-triazol-5-yl)-4,5-dihydrobenzo[g][1]benzothiole-2-carboximidate

Systemtic Name: 7-methoxy-N-(1H-1,2,4-triazol-5-yl)-4,5-dihydrobenzo[g][1]benzothiole-2-carboximidate Openeye Name: 7-methoxy-N-(1H-1,2,4-triazol-5-yl)-4,5-dihydrobenzo[g]benzothiophene-2-carboximidate CAS Name: 7-methoxy-N-(1H-1,2,4-triazol-5-yl)-4,5-dihydrobenzo[g][1]benzothiole-2-carboximidate IUPAC Name: 7-methoxy-N-(1H-1,2,4-triazol-5-yl)-4,5-dihydrobenzo[g][1]benzothiole-2-carboximidate Traditional Name: 7-methoxy-N-(1H-1,2,4-triazol-5-yl)-4,5-dihydrobenzo[g]benzothiophene-2-carboximidate Formula: C16H13N4O2S- MolecularWeight: 325.36502

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C3=C(CC2)C=C(S3)C(=NC4=NC=NN4)[O-]

Isomeric SMILES

COC1=CC2=C(C=C1)C3=C(CC2)C=C(S3)C(=NC4=NC=NN4)[O-]

InChI

InChI=1S/C16H14N4O2S/c1-22-11-4-5-12-9(6-11)2-3-10-7-13(23-14(10)12)15(21)19-16-17-8-18-20-16/h4-8H,2-3H2,1H3,(H2,17,18,19,20,21)/p-1