4-methoxy-N-[6-(3-oxidanylidenepiperazin-1-yl)carbonyl-1,3-benzothiazol-2-yl]benzenesulfonamide

Systemtic Name: 4-methoxy-N-[6-(3-oxidanylidenepiperazin-1-yl)carbonyl-1,3-benzothiazol-2-yl]benzenesulfonamide Openeye Name: 4-methoxy-N-[6-(3-oxopiperazine-1-carbonyl)-1,3-benzothiazol-2-yl]benzenesulfonamide CAS Name: 4-methoxy-N-[6-[oxo-(3-oxo-1-piperazinyl)methyl]-1,3-benzothiazol-2-yl]benzenesulfonamide IUPAC Name: 4-methoxy-N-[6-(3-oxopiperazine-1-carbonyl)-1,3-benzothiazol-2-yl]benzenesulfonamide Traditional Name: N-[6-(3-ketopiperazine-1-carbonyl)-1,3-benzothiazol-2-yl]-4-methoxy-benzenesulfonamide Formula: C19H18N4O5S2 MolecularWeight: 446.50002

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)N4CCNC(=O)C4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)N4CCNC(=O)C4

InChI

InChI=1S/C19H18N4O5S2/c1-28-13-3-5-14(6-4-13)30(26,27)22-19-21-15-7-2-12(10-16(15)29-19)18(25)23-9-8-20-17(24)11-23/h2-7,10H,8-9,11H2,1H3,(H,20,24)(H,21,22)