4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-(1-propylsulfonylpiperidin-4-yl)benzamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-(1-propylsulfonylpiperidin-4-yl)benzamide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-(1-propylsulfonyl-4-piperidyl)benzamide CAS Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-N-(1-propylsulfonyl-4-piperidinyl)benzamide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-(1-propylsulfonylpiperidin-4-yl)benzamide Traditional Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-N-(1-propylsulfonyl-4-piperidyl)benzamide Formula: C23H27N3O3S3 MolecularWeight: 489.67378

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCC(CC1)NC(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCCS(=O)(=O)N1CCC(CC1)NC(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C23H27N3O3S3/c1-2-15-32(28,29)26-13-11-19(12-14-26)24-22(27)18-9-7-17(8-10-18)16-30-23-25-20-5-3-4-6-21(20)31-23/h3-10,19H,2,11-16H2,1H3,(H,24,27)