4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[2-(thiophen-3-ylmethylsulfanyl)ethyl]piperazine-1-carboxamide

Systemtic Name: 4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[2-(thiophen-3-ylmethylsulfanyl)ethyl]piperazine-1-carboxamide Openeye Name: 4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[2-(3-thienylmethylsulfanyl)ethyl]piperazine-1-carboxamide CAS Name: 4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[2-(3-thiophenylmethylthio)ethyl]-1-piperazinecarboxamide IUPAC Name: 4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[2-(thiophen-3-ylmethylsulfanyl)ethyl]piperazine-1-carboxamide Traditional Name: 4-piazthiol-4-ylsulfonyl-N-[2-(3-thenylthio)ethyl]piperazine-1-carboxamide Formula: C18H21N5O3S4 MolecularWeight: 483.65104

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)NCCSCC2=CSC=C2)S(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

C1CN(CCN1C(=O)NCCSCC2=CSC=C2)S(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C18H21N5O3S4/c24-18(19-5-11-28-13-14-4-10-27-12-14)22-6-8-23(9-7-22)30(25,26)16-3-1-2-15-17(16)21-29-20-15/h1-4,10,12H,5-9,11,13H2,(H,19,24)