5-(1,4-diazepan-4-ium-1-ylsulfonyl)-6,7-dihydro-4H-thieno[3,2-c]pyridine

Systemtic Name: 5-(1,4-diazepan-4-ium-1-ylsulfonyl)-6,7-dihydro-4H-thieno[3,2-c]pyridine Openeye Name: 5-(1,4-diazepan-4-ium-1-ylsulfonyl)-6,7-dihydro-4H-thieno[3,2-c]pyridine CAS Name: 5-(1,4-diazepan-4-ium-1-ylsulfonyl)-6,7-dihydro-4H-thieno[3,2-c]pyridine IUPAC Name: 5-(1,4-diazepan-4-ium-1-ylsulfonyl)-6,7-dihydro-4H-thieno[3,2-c]pyridine Traditional Name: 5-(1,4-diazepan-4-ium-1-ylsulfonyl)-6,7-dihydro-4H-thieno[3,2-c]pyridine Formula: C12H20N3O2S2+ MolecularWeight: 302.4361

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCN(C1)S(=O)(=O)N2CCC3=C(C2)C=CS3

Isomeric SMILES

C1C[NH2+]CCN(C1)S(=O)(=O)N2CCC3=C(C2)C=CS3

InChI

InChI=1S/C12H19N3O2S2/c16-19(17,14-6-1-4-13-5-8-14)15-7-2-12-11(10-15)3-9-18-12/h3,9,13H,1-2,4-8,10H2/p+1