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

Systemtic Name: 3-[(4-prop-2-enyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-5-thiophen-2-yl-1,2-oxazole Openeye Name: 3-[[4-allyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-5-(2-thienyl)isoxazole CAS Name: 3-[[[4-prop-2-enyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]methyl]-5-thiophen-2-ylisoxazole IUPAC Name: 3-[(4-prop-2-enyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-5-thiophen-2-yl-1,2-oxazole Traditional Name: 3-[[[4-allyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]methyl]-5-(2-thienyl)isoxazole Formula: C18H15N5OS2 MolecularWeight: 381.4746

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC2=NOC(=C2)C3=CC=CS3)C4=CN=CC=C4

Isomeric SMILES

C=CCN1C(=NN=C1SCC2=NOC(=C2)C3=CC=CS3)C4=CN=CC=C4

InChI

InChI=1S/C18H15N5OS2/c1-2-8-23-17(13-5-3-7-19-11-13)20-21-18(23)26-12-14-10-15(24-22-14)16-6-4-9-25-16/h2-7,9-11H,1,8,12H2