2-[[5-cyclohexyl-4-[(Z)-furan-2-ylmethylideneamino]-1,2,4-triazol-3-yl]sulfanyl]ethanoate

Systemtic Name: 2-[[5-cyclohexyl-4-[(Z)-furan-2-ylmethylideneamino]-1,2,4-triazol-3-yl]sulfanyl]ethanoate Openeye Name: 2-[[5-cyclohexyl-4-[(Z)-2-furylmethyleneamino]-1,2,4-triazol-3-yl]sulfanyl]acetate CAS Name: 2-[[5-cyclohexyl-4-[(Z)-2-furanylmethylideneamino]-1,2,4-triazol-3-yl]thio]acetate IUPAC Name: 2-[[5-cyclohexyl-4-[(Z)-furan-2-ylmethylideneamino]-1,2,4-triazol-3-yl]sulfanyl]acetate Traditional Name: 2-[[5-cyclohexyl-4-[(Z)-2-furfurylideneamino]-1,2,4-triazol-3-yl]thio]acetate Formula: C15H17N4O3S- MolecularWeight: 333.38548

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NN=C(N2N=CC3=CC=CO3)SCC(=O)[O-]

Isomeric SMILES

C1CCC(CC1)C2=NN=C(N2/N=C\C3=CC=CO3)SCC(=O)[O-]

InChI

InChI=1S/C15H18N4O3S/c20-13(21)10-23-15-18-17-14(11-5-2-1-3-6-11)19(15)16-9-12-7-4-8-22-12/h4,7-9,11H,1-3,5-6,10H2,(H,20,21)/p-1/b16-9-