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

Systemtic Name: 3-[[5-methyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-5-thiophen-2-yl-1,2-oxazole Openeye Name: 3-[(4-benzyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-5-(2-thienyl)isoxazole CAS Name: 3-[[[5-methyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]thio]methyl]-5-thiophen-2-ylisoxazole IUPAC Name: 3-[(4-benzyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-5-thiophen-2-yl-1,2-oxazole Traditional Name: 3-[[(4-benzyl-5-methyl-1,2,4-triazol-3-yl)thio]methyl]-5-(2-thienyl)isoxazole Formula: C18H16N4OS2 MolecularWeight: 368.47584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1CC2=CC=CC=C2)SCC3=NOC(=C3)C4=CC=CS4

Isomeric SMILES

CC1=NN=C(N1CC2=CC=CC=C2)SCC3=NOC(=C3)C4=CC=CS4

InChI

InChI=1S/C18H16N4OS2/c1-13-19-20-18(22(13)11-14-6-3-2-4-7-14)25-12-15-10-16(23-21-15)17-8-5-9-24-17/h2-10H,11-12H2,1H3