1-(1H-benzimidazol-2-ylsulfanylmethyl)-4-methyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one

Systemtic Name: 1-(1H-benzimidazol-2-ylsulfanylmethyl)-4-methyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Openeye Name: 1-(1H-benzimidazol-2-ylsulfanylmethyl)-4-methyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one CAS Name: 1-[(1H-benzimidazol-2-ylthio)methyl]-4-methyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one IUPAC Name: 1-(1H-benzimidazol-2-ylsulfanylmethyl)-4-methyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Traditional Name: 1-[(1H-benzimidazol-2-ylthio)methyl]-4-methyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Formula: C18H14N6OS MolecularWeight: 362.40836

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2N3C1=NN=C3CSC4=NC5=CC=CC=C5N4

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2N3C1=NN=C3CSC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C18H14N6OS/c1-23-16(25)11-6-2-5-9-14(11)24-15(21-22-18(23)24)10-26-17-19-12-7-3-4-8-13(12)20-17/h2-9H,10H2,1H3,(H,19,20)