5-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-(2-methoxyphenyl)-1,2-oxazole

Systemtic Name: 5-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-(2-methoxyphenyl)-1,2-oxazole Openeye Name: 5-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-(2-methoxyphenyl)isoxazole CAS Name: 5-[[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)thio]methyl]-3-(2-methoxyphenyl)isoxazole IUPAC Name: 5-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-(2-methoxyphenyl)-1,2-oxazole Traditional Name: 5-[[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)thio]methyl]-3-(2-methoxyphenyl)isoxazole Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NOC(=C2)CSC3=NN(C(=N3)C4CC4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC=C1C2=NOC(=C2)CSC3=NN(C(=N3)C4CC4)C5=CC=CC=C5

InChI

InChI=1S/C22H20N4O2S/c1-27-20-10-6-5-9-18(20)19-13-17(28-25-19)14-29-22-23-21(15-11-12-15)26(24-22)16-7-3-2-4-8-16/h2-10,13,15H,11-12,14H2,1H3