2-[[5-(4-nitrophenyl)-4-(oxolan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanol

Systemtic Name: 2-[[5-(4-nitrophenyl)-4-(oxolan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanol Openeye Name: 2-[[5-(4-nitrophenyl)-4-(tetrahydrofuran-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanol CAS Name: 2-[[5-(4-nitrophenyl)-4-(2-oxolanylmethyl)-1,2,4-triazol-3-yl]thio]ethanol IUPAC Name: 2-[[5-(4-nitrophenyl)-4-(oxolan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanol Traditional Name: 2-[[5-(4-nitrophenyl)-4-(tetrahydrofurfuryl)-1,2,4-triazol-3-yl]thio]ethanol Formula: C15H18N4O4S MolecularWeight: 350.39282

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(=NN=C2SCCO)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC(OC1)CN2C(=NN=C2SCCO)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H18N4O4S/c20-7-9-24-15-17-16-14(18(15)10-13-2-1-8-23-13)11-3-5-12(6-4-11)19(21)22/h3-6,13,20H,1-2,7-10H2