3-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methylsulfanyl]-4-phenyl-1,2,4-triazole

Systemtic Name: 3-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methylsulfanyl]-4-phenyl-1,2,4-triazole Openeye Name: 3-[(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methylsulfanyl]-4-phenyl-1,2,4-triazole CAS Name: 3-[(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methylthio]-4-phenyl-1,2,4-triazole IUPAC Name: 3-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methylsulfanyl]-4-phenyl-1,2,4-triazole Traditional Name: 3-[(5-ethoxy-2-methyl-coumaran-6-yl)methylthio]-4-phenyl-1,2,4-triazole Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)CSC3=NN=CN3C4=CC=CC=C4

Isomeric SMILES

CCOC1=C(C=C2C(=C1)CC(O2)C)CSC3=NN=CN3C4=CC=CC=C4

InChI

InChI=1S/C20H21N3O2S/c1-3-24-18-10-15-9-14(2)25-19(15)11-16(18)12-26-20-22-21-13-23(20)17-7-5-4-6-8-17/h4-8,10-11,13-14H,3,9,12H2,1-2H3