N-[4-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-4-oxidanylidene-butyl]thiophene-3-carboxamide

Systemtic Name: N-[4-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-4-oxidanylidene-butyl]thiophene-3-carboxamide Openeye Name: N-[4-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-4-oxo-butyl]thiophene-3-carboxamide CAS Name: N-[4-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-1-piperazinyl]-4-oxobutyl]-3-thiophenecarboxamide IUPAC Name: N-[4-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-4-oxobutyl]thiophene-3-carboxamide Traditional Name: N-[4-keto-4-(4-piazthiol-4-ylsulfonylpiperazino)butyl]thiophene-3-carboxamide Formula: C19H21N5O4S3 MolecularWeight: 479.59614

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N5O4S3/c25-17(5-2-7-20-19(26)14-6-12-29-13-14)23-8-10-24(11-9-23)31(27,28)16-4-1-3-15-18(16)22-30-21-15/h1,3-4,6,12-13H,2,5,7-11H2,(H,20,26)