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

Systemtic Name: N-[(6-acetamido-1,3-benzothiazol-2-yl)carbamothioyl]butanamide Openeye Name: N-[(6-acetamido-1,3-benzothiazol-2-yl)carbamothioyl]butanamide CAS Name: N-[[(6-acetamido-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]butanamide IUPAC Name: N-[(6-acetamido-1,3-benzothiazol-2-yl)carbamothioyl]butanamide Traditional Name: N-[(6-acetamido-1,3-benzothiazol-2-yl)thiocarbamoyl]butyramide Formula: C14H16N4O2S2 MolecularWeight: 336.43244

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16N4O2S2/c1-3-4-12(20)17-13(21)18-14-16-10-6-5-9(15-8(2)19)7-11(10)22-14/h5-7H,3-4H2,1-2H3,(H,15,19)(H2,16,17,18,20,21)