1-(1H-imidazol-5-ylmethyl)-3,5-dihydro-2H-1,4-benzodiazepine-4-sulfinate

Systemtic Name: 1-(1H-imidazol-5-ylmethyl)-3,5-dihydro-2H-1,4-benzodiazepine-4-sulfinate Openeye Name: 1-(1H-imidazol-5-ylmethyl)-3,5-dihydro-2H-1,4-benzodiazepine-4-sulfinate CAS Name: 1-(1H-imidazol-5-ylmethyl)-3,5-dihydro-2H-1,4-benzodiazepine-4-sulfinate IUPAC Name: 1-(1H-imidazol-5-ylmethyl)-3,5-dihydro-2H-1,4-benzodiazepine-4-sulfinate Traditional Name: 1-(1H-imidazol-5-ylmethyl)-3,5-dihydro-2H-1,4-benzodiazepine-4-sulfinate Formula: C13H15N4O2S- MolecularWeight: 291.3488

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2CN1S(=O)[O-])CC3=CN=CN3

Isomeric SMILES

C1CN(C2=CC=CC=C2CN1S(=O)[O-])CC3=CN=CN3

InChI

InChI=1S/C13H16N4O2S/c18-20(19)17-6-5-16(9-12-7-14-10-15-12)13-4-2-1-3-11(13)8-17/h1-4,7,10H,5-6,8-9H2,(H,14,15)(H,18,19)/p-1