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

Systemtic Name: N-[6-(propanoylcarbamothioylamino)-1,3-benzothiazol-2-yl]butanamide Openeye Name: N-[6-(propanoylcarbamothioylamino)-1,3-benzothiazol-2-yl]butanamide CAS Name: N-[6-[[(1-oxopropylamino)-sulfanylidenemethyl]amino]-1,3-benzothiazol-2-yl]butanamide IUPAC Name: N-[6-(propanoylcarbamothioylamino)-1,3-benzothiazol-2-yl]butanamide Traditional Name: N-[6-(propionylthiocarbamoylamino)-1,3-benzothiazol-2-yl]butyramide Formula: C15H18N4O2S2 MolecularWeight: 350.45902

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18N4O2S2/c1-3-5-13(21)19-15-17-10-7-6-9(8-11(10)23-15)16-14(22)18-12(20)4-2/h6-8H,3-5H2,1-2H3,(H,17,19,21)(H2,16,18,20,22)