4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-phenacylsulfanyl-1H-1,2,4-triazol-5-one

Systemtic Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-phenacylsulfanyl-1H-1,2,4-triazol-5-one Openeye Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-phenacylsulfanyl-1H-1,2,4-triazol-5-one CAS Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(phenacylthio)-1H-1,2,4-triazol-5-one IUPAC Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-phenacylsulfanyl-1H-1,2,4-triazol-5-one Traditional Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(phenacylthio)-1H-1,2,4-triazol-5-one Formula: C18H15N3O4S MolecularWeight: 369.3944

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)N3C(=O)NN=C3SCC(=O)C4=CC=CC=C4

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)N3C(=O)NN=C3SCC(=O)C4=CC=CC=C4

InChI

InChI=1S/C18H15N3O4S/c22-14(12-4-2-1-3-5-12)11-26-18-20-19-17(23)21(18)13-6-7-15-16(10-13)25-9-8-24-15/h1-7,10H,8-9,11H2,(H,19,23)