4-chloranyl-N-(2-oxidanylideneazepan-3-yl)-N-(1,2,3-thiadiazol-4-ylmethyl)benzenesulfonamide

Systemtic Name: 4-chloranyl-N-(2-oxidanylideneazepan-3-yl)-N-(1,2,3-thiadiazol-4-ylmethyl)benzenesulfonamide Openeye Name: 4-chloro-N-(2-oxoazepan-3-yl)-N-(thiadiazol-4-ylmethyl)benzenesulfonamide CAS Name: 4-chloro-N-(2-oxo-3-azepanyl)-N-(4-thiadiazolylmethyl)benzenesulfonamide IUPAC Name: 4-chloro-N-(2-oxoazepan-3-yl)-N-(thiadiazol-4-ylmethyl)benzenesulfonamide Traditional Name: 4-chloro-N-(2-ketoazepan-3-yl)-N-(thiadiazol-4-ylmethyl)benzenesulfonamide Formula: C15H17ClN4O3S2 MolecularWeight: 400.90348

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)N(CC2=CSN=N2)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCNC(=O)C(C1)N(CC2=CSN=N2)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C15H17ClN4O3S2/c16-11-4-6-13(7-5-11)25(22,23)20(9-12-10-24-19-18-12)14-3-1-2-8-17-15(14)21/h4-7,10,14H,1-3,8-9H2,(H,17,21)