4-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-methylphenyl)butanamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-methylphenyl)butanamide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-(o-tolyl)butanamide CAS Name: 4-(1,3-benzothiazol-2-ylthio)-N-(2-methylphenyl)butanamide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-methylphenyl)butanamide Traditional Name: 4-(1,3-benzothiazol-2-ylthio)-N-(o-tolyl)butyramide Formula: C18H18N2OS2 MolecularWeight: 342.47832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)CCCSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=CC=CC=C1NC(=O)CCCSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H18N2OS2/c1-13-7-2-3-8-14(13)19-17(21)11-6-12-22-18-20-15-9-4-5-10-16(15)23-18/h2-5,7-10H,6,11-12H2,1H3,(H,19,21)