3-(cyclopentylsulfamoyl)-4-methoxy-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)benzamide

Systemtic Name: 3-(cyclopentylsulfamoyl)-4-methoxy-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)benzamide Openeye Name: 3-(cyclopentylsulfamoyl)-4-methoxy-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)benzamide CAS Name: 3-(cyclopentylsulfamoyl)-4-methoxy-N-[2-(methylthio)-1,3-benzothiazol-6-yl]benzamide IUPAC Name: 3-(cyclopentylsulfamoyl)-4-methoxy-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)benzamide Traditional Name: 3-(cyclopentylsulfamoyl)-4-methoxy-N-[2-(methylthio)-1,3-benzothiazol-6-yl]benzamide Formula: C21H23N3O4S3 MolecularWeight: 477.62002

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SC)S(=O)(=O)NC4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SC)S(=O)(=O)NC4CCCC4

InChI

InChI=1S/C21H23N3O4S3/c1-28-17-10-7-13(11-19(17)31(26,27)24-14-5-3-4-6-14)20(25)22-15-8-9-16-18(12-15)30-21(23-16)29-2/h7-12,14,24H,3-6H2,1-2H3,(H,22,25)