2-[[4-cyclopropyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-5,6-dimethoxy-2,3-dihydroinden-1-one

Systemtic Name: 2-[[4-cyclopropyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-5,6-dimethoxy-2,3-dihydroinden-1-one Openeye Name: 2-[[4-cyclopropyl-5-(2-furyl)-1,2,4-triazol-3-yl]sulfanyl]-5,6-dimethoxy-indan-1-one CAS Name: 2-[[4-cyclopropyl-5-(2-furanyl)-1,2,4-triazol-3-yl]thio]-5,6-dimethoxy-2,3-dihydroinden-1-one IUPAC Name: 2-[[4-cyclopropyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-5,6-dimethoxy-2,3-dihydroinden-1-one Traditional Name: 2-[[4-cyclopropyl-5-(2-furyl)-1,2,4-triazol-3-yl]thio]-5,6-dimethoxy-indan-1-one Formula: C20H19N3O4S MolecularWeight: 397.44756

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CC(C2=O)SC3=NN=C(N3C4CC4)C5=CC=CO5)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CC(C2=O)SC3=NN=C(N3C4CC4)C5=CC=CO5)OC

InChI

InChI=1S/C20H19N3O4S/c1-25-15-8-11-9-17(18(24)13(11)10-16(15)26-2)28-20-22-21-19(14-4-3-7-27-14)23(20)12-5-6-12/h3-4,7-8,10,12,17H,5-6,9H2,1-2H3