1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[3-(cyclopropylamino)-3-oxidanylidene-propyl]piperidine-3-carboxamide

Systemtic Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[3-(cyclopropylamino)-3-oxidanylidene-propyl]piperidine-3-carboxamide Openeye Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[3-(cyclopropylamino)-3-oxo-propyl]piperidine-3-carboxamide CAS Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[3-(cyclopropylamino)-3-oxopropyl]-3-piperidinecarboxamide IUPAC Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[3-(cyclopropylamino)-3-oxopropyl]piperidine-3-carboxamide Traditional Name: N-[3-(cyclopropylamino)-3-keto-propyl]-1-piazthiol-4-ylsulfonyl-nipecotamide Formula: C18H23N5O4S2 MolecularWeight: 437.53632

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CC3=NSN=C32)C(=O)NCCC(=O)NC4CC4

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=CC3=NSN=C32)C(=O)NCCC(=O)NC4CC4

InChI

InChI=1S/C18H23N5O4S2/c24-16(20-13-6-7-13)8-9-19-18(25)12-3-2-10-23(11-12)29(26,27)15-5-1-4-14-17(15)22-28-21-14/h1,4-5,12-13H,2-3,6-11H2,(H,19,25)(H,20,24)