2-(5-methylsulfanyl-4-prop-2-enyl-1,5-dihydro-1,2,4-triazol-3-yl)-1H-quinazolin-4-one

Systemtic Name: 2-(5-methylsulfanyl-4-prop-2-enyl-1,5-dihydro-1,2,4-triazol-3-yl)-1H-quinazolin-4-one Openeye Name: 2-(4-allyl-5-methylsulfanyl-1,5-dihydro-1,2,4-triazol-3-yl)-1H-quinazolin-4-one CAS Name: 2-[5-(methylthio)-4-prop-2-enyl-1,5-dihydro-1,2,4-triazol-3-yl]-1H-quinazolin-4-one IUPAC Name: 2-(5-methylsulfanyl-4-prop-2-enyl-1,5-dihydro-1,2,4-triazol-3-yl)-1H-quinazolin-4-one Traditional Name: 2-[4-allyl-5-(methylthio)-1,5-dihydro-1,2,4-triazol-3-yl]-1H-quinazolin-4-one Formula: C14H15N5OS MolecularWeight: 301.3668

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Descriptors Computed from Structure

Canonical SMILES:

CSC1NN=C(N1CC=C)C2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CSC1NN=C(N1CC=C)C2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C14H15N5OS/c1-3-8-19-12(17-18-14(19)21-2)11-15-10-7-5-4-6-9(10)13(20)16-11/h3-7,14,18H,1,8H2,2H3,(H,15,16,20)