1-[[5-(2-methylfuran-3-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-3-(3-nitrophenoxy)propan-2-ol

Systemtic Name: 1-[[5-(2-methylfuran-3-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-3-(3-nitrophenoxy)propan-2-ol Openeye Name: 1-[[5-(2-methyl-3-furyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-3-(3-nitrophenoxy)propan-2-ol CAS Name: 1-[[5-(2-methyl-3-furanyl)-4-phenyl-1,2,4-triazol-3-yl]thio]-3-(3-nitrophenoxy)-2-propanol IUPAC Name: 1-[[5-(2-methylfuran-3-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-3-(3-nitrophenoxy)propan-2-ol Traditional Name: 1-[[5-(2-methyl-3-furyl)-4-phenyl-1,2,4-triazol-3-yl]thio]-3-(3-nitrophenoxy)propan-2-ol Formula: C22H20N4O5S MolecularWeight: 452.483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C2=NN=C(N2C3=CC=CC=C3)SCC(COC4=CC=CC(=C4)[N+](=O)[O-])O

Isomeric SMILES

CC1=C(C=CO1)C2=NN=C(N2C3=CC=CC=C3)SCC(COC4=CC=CC(=C4)[N+](=O)[O-])O

InChI

InChI=1S/C22H20N4O5S/c1-15-20(10-11-30-15)21-23-24-22(25(21)16-6-3-2-4-7-16)32-14-18(27)13-31-19-9-5-8-17(12-19)26(28)29/h2-12,18,27H,13-14H2,1H3