3-[[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoylamino]carbamoyl]-N-(4-methoxyphenyl)benzenesulfonamide

Systemtic Name: 3-[[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoylamino]carbamoyl]-N-(4-methoxyphenyl)benzenesulfonamide Openeye Name: 3-[[[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]amino]carbamoyl]-N-(4-methoxyphenyl)benzenesulfonamide CAS Name: 3-[[[2-(1,3-benzothiazol-2-ylthio)-1-oxoethyl]hydrazo]-oxomethyl]-N-(4-methoxyphenyl)benzenesulfonamide IUPAC Name: 3-[[[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]amino]carbamoyl]-N-(4-methoxyphenyl)benzenesulfonamide Traditional Name: 3-[[[2-(1,3-benzothiazol-2-ylthio)acetyl]amino]carbamoyl]-N-(4-methoxyphenyl)benzenesulfonamide Formula: C23H20N4O5S3 MolecularWeight: 528.6237

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=O)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=O)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C23H20N4O5S3/c1-32-17-11-9-16(10-12-17)27-35(30,31)18-6-4-5-15(13-18)22(29)26-25-21(28)14-33-23-24-19-7-2-3-8-20(19)34-23/h2-13,27H,14H2,1H3,(H,25,28)(H,26,29)