2-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 2-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 2-[[[5-(methylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 2-[[[5-(methylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]-1H-quinazolin-4-one Formula: C12H11N5OS2 MolecularWeight: 305.37864

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NN=C(S1)SCC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CNC1=NN=C(S1)SCC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C12H11N5OS2/c1-13-11-16-17-12(20-11)19-6-9-14-8-5-3-2-4-7(8)10(18)15-9/h2-5H,6H2,1H3,(H,13,16)(H,14,15,18)