3-[5-(1,3-benzothiazol-2-ylmethylsulfanyl)-4-ethyl-1,2,4-triazol-3-yl]propanamide

Systemtic Name: 3-[5-(1,3-benzothiazol-2-ylmethylsulfanyl)-4-ethyl-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[5-(1,3-benzothiazol-2-ylmethylsulfanyl)-4-ethyl-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[5-(1,3-benzothiazol-2-ylmethylthio)-4-ethyl-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[5-(1,3-benzothiazol-2-ylmethylsulfanyl)-4-ethyl-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[5-(1,3-benzothiazol-2-ylmethylthio)-4-ethyl-1,2,4-triazol-3-yl]propionamide Formula: C15H17N5OS2 MolecularWeight: 347.45838

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=NC3=CC=CC=C3S2)CCC(=O)N

Isomeric SMILES

CCN1C(=NN=C1SCC2=NC3=CC=CC=C3S2)CCC(=O)N

InChI

InChI=1S/C15H17N5OS2/c1-2-20-13(8-7-12(16)21)18-19-15(20)22-9-14-17-10-5-3-4-6-11(10)23-14/h3-6H,2,7-9H2,1H3,(H2,16,21)