3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1H-imidazole-2-thione

Systemtic Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1H-imidazole-2-thione Openeye Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1H-imidazole-2-thione CAS Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1H-imidazole-2-thione IUPAC Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1H-imidazole-2-thione Traditional Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-imidazoline-2-thione Formula: C12H12N2O2S MolecularWeight: 248.30088

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)N3C=CNC3=S)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)N3C=CNC3=S)OC1

InChI

InChI=1S/C12H12N2O2S/c17-12-13-4-5-14(12)9-2-3-10-11(8-9)16-7-1-6-15-10/h2-5,8H,1,6-7H2,(H,13,17)