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

Systemtic Name: 5-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methylsulfanylmethyl]-1-phenyl-1,2,3,4-tetrazole Openeye Name: 5-[(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methylsulfanylmethyl]-1-phenyl-tetrazole CAS Name: 5-[[(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methylthio]methyl]-1-phenyltetrazole IUPAC Name: 5-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methylsulfanylmethyl]-1-phenyltetrazole Traditional Name: 5-[[(5-ethoxy-2-methyl-coumaran-6-yl)methylthio]methyl]-1-phenyl-tetrazole Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)CSCC3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

CCOC1=C(C=C2C(=C1)CC(O2)C)CSCC3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C20H22N4O2S/c1-3-25-18-10-15-9-14(2)26-19(15)11-16(18)12-27-13-20-21-22-23-24(20)17-7-5-4-6-8-17/h4-8,10-11,14H,3,9,12-13H2,1-2H3