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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NOC(=C2)CSC3=NNC(=N3)C4CC4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NOC(=C2)CSC3=NNC(=N3)C4CC4

InChI

InChI=1S/C16H16N4O2S/c1-21-12-6-4-10(5-7-12)14-8-13(22-20-14)9-23-16-17-15(18-19-16)11-2-3-11/h4-8,11H,2-3,9H2,1H3,(H,17,18,19)