N-[[3-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]carbamothioyl]hexanamide

Systemtic Name: N-[[3-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]carbamothioyl]hexanamide Openeye Name: N-[[3-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]carbamothioyl]hexanamide CAS Name: N-[[3-(1,3-benzothiazol-2-yl)-2-methylanilino]-sulfanylidenemethyl]hexanamide IUPAC Name: N-[[3-(1,3-benzothiazol-2-yl)-2-methylphenyl]carbamothioyl]hexanamide Traditional Name: N-[[3-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]thiocarbamoyl]hexanamide Formula: C21H23N3OS2 MolecularWeight: 397.55682

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(=S)NC1=CC=CC(=C1C)C2=NC3=CC=CC=C3S2

Isomeric SMILES

CCCCCC(=O)NC(=S)NC1=CC=CC(=C1C)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C21H23N3OS2/c1-3-4-5-13-19(25)24-21(26)23-16-11-8-9-15(14(16)2)20-22-17-10-6-7-12-18(17)27-20/h6-12H,3-5,13H2,1-2H3,(H2,23,24,25,26)