N-(1H-1,2,4-triazol-5-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboximidate

Systemtic Name: N-(1H-1,2,4-triazol-5-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboximidate Openeye Name: N-(1H-1,2,4-triazol-5-yl)-4,5,6,7-tetrahydrobenzothiophene-3-carboximidate CAS Name: N-(1H-1,2,4-triazol-5-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboximidate IUPAC Name: N-(1H-1,2,4-triazol-5-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboximidate Traditional Name: N-(1H-1,2,4-triazol-5-yl)-4,5,6,7-tetrahydrobenzothiophene-3-carboximidate Formula: C11H11N4OS- MolecularWeight: 247.29624

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=CS2)C(=NC3=NC=NN3)[O-]

Isomeric SMILES

C1CCC2=C(C1)C(=CS2)C(=NC3=NC=NN3)[O-]

InChI

InChI=1S/C11H12N4OS/c16-10(14-11-12-6-13-15-11)8-5-17-9-4-2-1-3-7(8)9/h5-6H,1-4H2,(H2,12,13,14,15,16)/p-1