4-[4-(1,3-benzothiazol-2-ylsulfanyl)butanoylamino]-N-methyl-benzamide

Systemtic Name: 4-[4-(1,3-benzothiazol-2-ylsulfanyl)butanoylamino]-N-methyl-benzamide Openeye Name: 4-[4-(1,3-benzothiazol-2-ylsulfanyl)butanoylamino]-N-methyl-benzamide CAS Name: 4-[[4-(1,3-benzothiazol-2-ylthio)-1-oxobutyl]amino]-N-methylbenzamide IUPAC Name: 4-[4-(1,3-benzothiazol-2-ylsulfanyl)butanoylamino]-N-methylbenzamide Traditional Name: 4-[4-(1,3-benzothiazol-2-ylthio)butanoylamino]-N-methyl-benzamide Formula: C19H19N3O2S2 MolecularWeight: 385.50306

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)NC(=O)CCCSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)NC(=O)CCCSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H19N3O2S2/c1-20-18(24)13-8-10-14(11-9-13)21-17(23)7-4-12-25-19-22-15-5-2-3-6-16(15)26-19/h2-3,5-6,8-11H,4,7,12H2,1H3,(H,20,24)(H,21,23)