4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[[3-(methylsulfonylamino)phenyl]methyl]benzamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[[3-(methylsulfonylamino)phenyl]methyl]benzamide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[[3-(methanesulfonamido)phenyl]methyl]benzamide CAS Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-N-[[3-(methanesulfonamido)phenyl]methyl]benzamide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[[3-(methanesulfonamido)phenyl]methyl]benzamide Traditional Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-N-[3-(methanesulfonamido)benzyl]benzamide Formula: C23H21N3O3S3 MolecularWeight: 483.62614

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=CC(=C1)CNC(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

CS(=O)(=O)NC1=CC=CC(=C1)CNC(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C23H21N3O3S3/c1-32(28,29)26-19-6-4-5-17(13-19)14-24-22(27)18-11-9-16(10-12-18)15-30-23-25-20-7-2-3-8-21(20)31-23/h2-13,26H,14-15H2,1H3,(H,24,27)