4-([1,2,3,4]tetrazolo[1,5-b]pyridazin-6-yl)-1,4-thiazepane

Systemtic Name: 4-([1,2,3,4]tetrazolo[1,5-b]pyridazin-6-yl)-1,4-thiazepane Openeye Name: 4-(tetrazolo[1,5-b]pyridazin-6-yl)-1,4-thiazepane CAS Name: 4-(6-tetrazolo[1,5-b]pyridazinyl)-1,4-thiazepane IUPAC Name: 4-(tetrazolo[1,5-b]pyridazin-6-yl)-1,4-thiazepane Traditional Name: 4-(tetrazolo[1,5-b]pyridazin-6-yl)-1,4-thiazepane Formula: C9H12N6S MolecularWeight: 236.29678

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCSC1)C2=NN3C(=NN=N3)C=C2

Isomeric SMILES

C1CN(CCSC1)C2=NN3C(=NN=N3)C=C2

InChI

InChI=1S/C9H12N6S/c1-4-14(5-7-16-6-1)9-3-2-8-10-12-13-15(8)11-9/h2-3H,1,4-7H2