1-[3-(furan-2-yl)-5-methylsulfanyl-1,2,4-triazol-1-yl]-3-phenyl-propan-1-one

Systemtic Name: 1-[3-(furan-2-yl)-5-methylsulfanyl-1,2,4-triazol-1-yl]-3-phenyl-propan-1-one Openeye Name: 1-[3-(2-furyl)-5-methylsulfanyl-1,2,4-triazol-1-yl]-3-phenyl-propan-1-one CAS Name: 1-[3-(2-furanyl)-5-(methylthio)-1,2,4-triazol-1-yl]-3-phenyl-1-propanone IUPAC Name: 1-[3-(furan-2-yl)-5-methylsulfanyl-1,2,4-triazol-1-yl]-3-phenylpropan-1-one Traditional Name: 1-[3-(2-furyl)-5-(methylthio)-1,2,4-triazol-1-yl]-3-phenyl-propan-1-one Formula: C16H15N3O2S MolecularWeight: 313.3742

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=NN1C(=O)CCC2=CC=CC=C2)C3=CC=CO3

Isomeric SMILES

CSC1=NC(=NN1C(=O)CCC2=CC=CC=C2)C3=CC=CO3

InChI

InChI=1S/C16H15N3O2S/c1-22-16-17-15(13-8-5-11-21-13)18-19(16)14(20)10-9-12-6-3-2-4-7-12/h2-8,11H,9-10H2,1H3