1-[[5-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propan-2-one

Systemtic Name: 1-[[5-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propan-2-one Openeye Name: 1-[[5-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propan-2-one CAS Name: 1-[[5-[(1,3-benzothiazol-2-ylthio)methyl]-4-methyl-1,2,4-triazol-3-yl]thio]-2-propanone IUPAC Name: 1-[[5-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propan-2-one Traditional Name: 1-[[5-[(1,3-benzothiazol-2-ylthio)methyl]-4-methyl-1,2,4-triazol-3-yl]thio]acetone Formula: C14H14N4OS3 MolecularWeight: 350.48216

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1=NN=C(N1C)CSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(=O)CSC1=NN=C(N1C)CSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C14H14N4OS3/c1-9(19)7-20-13-17-16-12(18(13)2)8-21-14-15-10-5-3-4-6-11(10)22-14/h3-6H,7-8H2,1-2H3