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

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

Systemtic Name:N-[6-(propanoylcarbamothioylamino)-1,3-benzothiazol-2-yl]propanamide
Openeye Name:N-[6-(propanoylcarbamothioylamino)-1,3-benzothiazol-2-yl]propanamide
CAS Name:N-[6-[[(1-oxopropylamino)-sulfanylidenemethyl]amino]-1,3-benzothiazol-2-yl]propanamide
IUPAC Name:N-[6-(propanoylcarbamothioylamino)-1,3-benzothiazol-2-yl]propanamide
Traditional Name:N-[6-(propionylthiocarbamoylamino)-1,3-benzothiazol-2-yl]propionamide
Formula: C14H16N4O2S2
MolecularWeight: 336.43244
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

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


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