1-[[1-(2-methoxy-5-methyl-phenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-3-naphthalen-1-yloxy-propan-2-ol

Systemtic Name: 1-[[1-(2-methoxy-5-methyl-phenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-3-naphthalen-1-yloxy-propan-2-ol Openeye Name: 1-[1-(2-methoxy-5-methyl-phenyl)tetrazol-5-yl]sulfanyl-3-(1-naphthyloxy)propan-2-ol CAS Name: 1-[[1-(2-methoxy-5-methylphenyl)-5-tetrazolyl]thio]-3-(1-naphthalenyloxy)-2-propanol IUPAC Name: 1-[1-(2-methoxy-5-methylphenyl)tetrazol-5-yl]sulfanyl-3-naphthalen-1-yloxypropan-2-ol Traditional Name: 1-[[1-(2-methoxy-5-methyl-phenyl)tetrazol-5-yl]thio]-3-(1-naphthoxy)propan-2-ol Formula: C22H22N4O3S MolecularWeight: 422.50008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)N2C(=NN=N2)SCC(COC3=CC=CC4=CC=CC=C43)O

Isomeric SMILES

CC1=CC(=C(C=C1)OC)N2C(=NN=N2)SCC(COC3=CC=CC4=CC=CC=C43)O

InChI

InChI=1S/C22H22N4O3S/c1-15-10-11-21(28-2)19(12-15)26-22(23-24-25-26)30-14-17(27)13-29-20-9-5-7-16-6-3-4-8-18(16)20/h3-12,17,27H,13-14H2,1-2H3