N-(6-azanyl-1,3-benzothiazol-2-yl)azepane-1-sulfonamide

Systemtic Name: N-(6-azanyl-1,3-benzothiazol-2-yl)azepane-1-sulfonamide Openeye Name: N-(6-amino-1,3-benzothiazol-2-yl)azepane-1-sulfonamide CAS Name: N-(6-amino-1,3-benzothiazol-2-yl)-1-azepanesulfonamide IUPAC Name: N-(6-amino-1,3-benzothiazol-2-yl)azepane-1-sulfonamide Traditional Name: N-(6-amino-1,3-benzothiazol-2-yl)azepane-1-sulfonamide Formula: C13H18N4O2S2 MolecularWeight: 326.43762

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)NC2=NC3=C(S2)C=C(C=C3)N

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)NC2=NC3=C(S2)C=C(C=C3)N

InChI

InChI=1S/C13H18N4O2S2/c14-10-5-6-11-12(9-10)20-13(15-11)16-21(18,19)17-7-3-1-2-4-8-17/h5-6,9H,1-4,7-8,14H2,(H,15,16)