N-[(5-chloranyl-6-methoxy-1,3-benzothiazol-2-yl)carbamothioyl]hexanamide

Systemtic Name: N-[(5-chloranyl-6-methoxy-1,3-benzothiazol-2-yl)carbamothioyl]hexanamide Openeye Name: N-[(5-chloro-6-methoxy-1,3-benzothiazol-2-yl)carbamothioyl]hexanamide CAS Name: N-[[(5-chloro-6-methoxy-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]hexanamide IUPAC Name: N-[(5-chloro-6-methoxy-1,3-benzothiazol-2-yl)carbamothioyl]hexanamide Traditional Name: N-[(5-chloro-6-methoxy-1,3-benzothiazol-2-yl)thiocarbamoyl]hexanamide Formula: C15H18ClN3O2S2 MolecularWeight: 371.90532

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(=S)NC1=NC2=CC(=C(C=C2S1)OC)Cl

Isomeric SMILES

CCCCCC(=O)NC(=S)NC1=NC2=CC(=C(C=C2S1)OC)Cl

InChI

InChI=1S/C15H18ClN3O2S2/c1-3-4-5-6-13(20)18-14(22)19-15-17-10-7-9(16)11(21-2)8-12(10)23-15/h7-8H,3-6H2,1-2H3,(H2,17,18,19,20,22)