7-chloranyl-2-[(4-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[(4-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 7-chloro-2-[(4-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 7-chloro-2-[[(4-ethyl-1,2,4-triazol-3-yl)thio]methyl]-1H-quinazolin-4-one IUPAC Name: 7-chloro-2-[(4-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 7-chloro-2-[[(4-ethyl-1,2,4-triazol-3-yl)thio]methyl]-1H-quinazolin-4-one Formula: C13H12ClN5OS MolecularWeight: 321.78528

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NN=C1SCC2=NC(=O)C3=C(N2)C=C(C=C3)Cl

Isomeric SMILES

CCN1C=NN=C1SCC2=NC(=O)C3=C(N2)C=C(C=C3)Cl

InChI

InChI=1S/C13H12ClN5OS/c1-2-19-7-15-18-13(19)21-6-11-16-10-5-8(14)3-4-9(10)12(20)17-11/h3-5,7H,2,6H2,1H3,(H,16,17,20)