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

Systemtic Name: 5-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-3-(2-methoxyphenyl)-1,2-oxazole Openeye Name: 5-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-3-(2-methoxyphenyl)isoxazole CAS Name: 5-[[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)thio]methyl]-3-(2-methoxyphenyl)isoxazole IUPAC Name: 5-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-3-(2-methoxyphenyl)-1,2-oxazole Traditional Name: 5-[[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)thio]methyl]-3-(2-methoxyphenyl)isoxazole Formula: C18H20N4O2S MolecularWeight: 356.442

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NOC(=C2)CSC3=NNC(=N3)C4CCCC4

Isomeric SMILES

COC1=CC=CC=C1C2=NOC(=C2)CSC3=NNC(=N3)C4CCCC4

InChI

InChI=1S/C18H20N4O2S/c1-23-16-9-5-4-8-14(16)15-10-13(24-22-15)11-25-18-19-17(20-21-18)12-6-2-3-7-12/h4-5,8-10,12H,2-3,6-7,11H2,1H3,(H,19,20,21)