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

Systemtic Name: 3-(2-methoxyphenyl)-5-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,2-oxazole Openeye Name: 5-[(4-allyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-(2-methoxyphenyl)isoxazole CAS Name: 3-(2-methoxyphenyl)-5-[[(4-prop-2-enyl-1,2,4-triazol-3-yl)thio]methyl]isoxazole IUPAC Name: 3-(2-methoxyphenyl)-5-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,2-oxazole Traditional Name: 5-[[(4-allyl-1,2,4-triazol-3-yl)thio]methyl]-3-(2-methoxyphenyl)isoxazole Formula: C16H16N4O2S MolecularWeight: 328.38884

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NOC(=C2)CSC3=NN=CN3CC=C

Isomeric SMILES

COC1=CC=CC=C1C2=NOC(=C2)CSC3=NN=CN3CC=C

InChI

InChI=1S/C16H16N4O2S/c1-3-8-20-11-17-18-16(20)23-10-12-9-14(19-22-12)13-6-4-5-7-15(13)21-2/h3-7,9,11H,1,8,10H2,2H3