3-[4-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-4-oxidanylidene-butyl]-1,3-benzoxazol-2-one

Systemtic Name: 3-[4-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-4-oxidanylidene-butyl]-1,3-benzoxazol-2-one Openeye Name: 3-[4-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-4-oxo-butyl]-1,3-benzoxazol-2-one CAS Name: 3-[4-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-1-piperazinyl]-4-oxobutyl]-1,3-benzoxazol-2-one IUPAC Name: 3-[4-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-4-oxobutyl]-1,3-benzoxazol-2-one Traditional Name: 3-[4-keto-4-(4-piazthiol-4-ylsulfonylpiperazino)butyl]-1,3-benzoxazol-2-one Formula: C21H21N5O5S2 MolecularWeight: 487.55194

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCCN2C3=CC=CC=C3OC2=O)S(=O)(=O)C4=CC=CC5=NSN=C54

Isomeric SMILES

C1CN(CCN1C(=O)CCCN2C3=CC=CC=C3OC2=O)S(=O)(=O)C4=CC=CC5=NSN=C54

InChI

InChI=1S/C21H21N5O5S2/c27-19(9-4-10-26-16-6-1-2-7-17(16)31-21(26)28)24-11-13-25(14-12-24)33(29,30)18-8-3-5-15-20(18)23-32-22-15/h1-3,5-8H,4,9-14H2