N-[(6-acetamido-1,3-benzothiazol-2-yl)carbamothioyl]hexanamide

Systemtic Name: N-[(6-acetamido-1,3-benzothiazol-2-yl)carbamothioyl]hexanamide Openeye Name: N-[(6-acetamido-1,3-benzothiazol-2-yl)carbamothioyl]hexanamide CAS Name: N-[[(6-acetamido-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]hexanamide IUPAC Name: N-[(6-acetamido-1,3-benzothiazol-2-yl)carbamothioyl]hexanamide Traditional Name: N-[(6-acetamido-1,3-benzothiazol-2-yl)thiocarbamoyl]hexanamide Formula: C16H20N4O2S2 MolecularWeight: 364.4856

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(=S)NC1=NC2=C(S1)C=C(C=C2)NC(=O)C

Isomeric SMILES

CCCCCC(=O)NC(=S)NC1=NC2=C(S1)C=C(C=C2)NC(=O)C

InChI

InChI=1S/C16H20N4O2S2/c1-3-4-5-6-14(22)19-15(23)20-16-18-12-8-7-11(17-10(2)21)9-13(12)24-16/h7-9H,3-6H2,1-2H3,(H,17,21)(H2,18,19,20,22,23)