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

Systemtic Name: 3-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-5-phenyl-1,2-oxazole Openeye Name: 3-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-5-phenyl-isoxazole CAS Name: 3-[[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)thio]methyl]-5-phenylisoxazole IUPAC Name: 3-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-5-phenyl-1,2-oxazole Traditional Name: 3-[[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)thio]methyl]-5-phenyl-isoxazole Formula: C16H16N4OS MolecularWeight: 312.38944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2CC2)SCC3=NOC(=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN=C(N1C2CC2)SCC3=NOC(=C3)C4=CC=CC=C4

InChI

InChI=1S/C16H16N4OS/c1-11-17-18-16(20(11)14-7-8-14)22-10-13-9-15(21-19-13)12-5-3-2-4-6-12/h2-6,9,14H,7-8,10H2,1H3