N-[N'-(1,3-benzothiazol-2-yl)-N-propanoyl-carbamimidoyl]propanamide

Systemtic Name: N-[N'-(1,3-benzothiazol-2-yl)-N-propanoyl-carbamimidoyl]propanamide Openeye Name: N-[N'-(1,3-benzothiazol-2-yl)-N-propanoyl-carbamimidoyl]propanamide CAS Name: N-[1,3-benzothiazol-2-ylimino-(1-oxopropylamino)methyl]propanamide IUPAC Name: N-[N'-(1,3-benzothiazol-2-yl)-N-propanoylcarbamimidoyl]propanamide Traditional Name: N-[N'-(1,3-benzothiazol-2-yl)-N-propionyl-amidino]propionamide Formula: C14H16N4O2S MolecularWeight: 304.36744

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC(=NC1=NC2=CC=CC=C2S1)NC(=O)CC

Isomeric SMILES

CCC(=O)NC(=NC1=NC2=CC=CC=C2S1)NC(=O)CC

InChI

InChI=1S/C14H16N4O2S/c1-3-11(19)16-13(17-12(20)4-2)18-14-15-9-7-5-6-8-10(9)21-14/h5-8H,3-4H2,1-2H3,(H2,15,16,17,18,19,20)