7-(1,4-diazepan-1-ylsulfonyl)-1,3-benzothiazole

Systemtic Name: 7-(1,4-diazepan-1-ylsulfonyl)-1,3-benzothiazole Openeye Name: 7-(1,4-diazepan-1-ylsulfonyl)-1,3-benzothiazole CAS Name: 7-(1,4-diazepan-1-ylsulfonyl)-1,3-benzothiazole IUPAC Name: 7-(1,4-diazepan-1-ylsulfonyl)-1,3-benzothiazole Traditional Name: 7-(1,4-diazepan-1-ylsulfonyl)-1,3-benzothiazole Formula: C12H15N3O2S2 MolecularWeight: 297.3964

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)S(=O)(=O)C2=CC=CC3=C2SC=N3

Isomeric SMILES

C1CNCCN(C1)S(=O)(=O)C2=CC=CC3=C2SC=N3

InChI

InChI=1S/C12H15N3O2S2/c16-19(17,15-7-2-5-13-6-8-15)11-4-1-3-10-12(11)18-9-14-10/h1,3-4,9,13H,2,5-8H2