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

Systemtic Name: 5-[(5-cyclopropyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-methyl-1,2-oxazole Openeye Name: 5-[(4-allyl-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-methyl-isoxazole CAS Name: 5-[[(5-cyclopropyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]methyl]-3-methylisoxazole IUPAC Name: 5-[(5-cyclopropyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-methyl-1,2-oxazole Traditional Name: 5-[[(4-allyl-5-cyclopropyl-1,2,4-triazol-3-yl)thio]methyl]-3-methyl-isoxazole Formula: C13H16N4OS MolecularWeight: 276.35734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)CSC2=NN=C(N2CC=C)C3CC3

Isomeric SMILES

CC1=NOC(=C1)CSC2=NN=C(N2CC=C)C3CC3

InChI

InChI=1S/C13H16N4OS/c1-3-6-17-12(10-4-5-10)14-15-13(17)19-8-11-7-9(2)16-18-11/h3,7,10H,1,4-6,8H2,2H3