4-[4-(furan-2-ylmethyl)-3-(oxolan-2-ylmethylsulfanyl)-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[4-(furan-2-ylmethyl)-3-(oxolan-2-ylmethylsulfanyl)-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[4-(2-furylmethyl)-3-(tetrahydrofuran-2-ylmethylsulfanyl)-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[4-(2-furanylmethyl)-3-(2-oxolanylmethylthio)-1H-1,2,4-triazol-5-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[4-(furan-2-ylmethyl)-3-(oxolan-2-ylmethylsulfanyl)-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[4-(2-furfuryl)-3-(tetrahydrofurfurylthio)-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,5-dien-1-one Formula: C18H19N3O3S MolecularWeight: 357.42676

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CSC2=NNC(=C3C=CC(=O)C=C3)N2CC4=CC=CO4

Isomeric SMILES

C1CC(OC1)CSC2=NNC(=C3C=CC(=O)C=C3)N2CC4=CC=CO4

InChI

InChI=1S/C18H19N3O3S/c22-14-7-5-13(6-8-14)17-19-20-18(25-12-16-4-2-10-24-16)21(17)11-15-3-1-9-23-15/h1,3,5-9,16,19H,2,4,10-12H2