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

Systemtic Name: 4-[(4-cyclopropyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-(2,4-dimethylphenyl)-1,3-oxazole Openeye Name: 4-[[4-cyclopropyl-5-(1-piperidyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-2-(2,4-dimethylphenyl)oxazole CAS Name: 4-[[[4-cyclopropyl-5-(1-piperidinyl)-1,2,4-triazol-3-yl]thio]methyl]-2-(2,4-dimethylphenyl)oxazole IUPAC Name: 4-[(4-cyclopropyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-(2,4-dimethylphenyl)-1,3-oxazole Traditional Name: 4-[[(4-cyclopropyl-5-piperidino-1,2,4-triazol-3-yl)thio]methyl]-2-(2,4-dimethylphenyl)oxazole Formula: C22H27N5OS MolecularWeight: 409.54768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=NC(=CO2)CSC3=NN=C(N3C4CC4)N5CCCCC5)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=NC(=CO2)CSC3=NN=C(N3C4CC4)N5CCCCC5)C

InChI

InChI=1S/C22H27N5OS/c1-15-6-9-19(16(2)12-15)20-23-17(13-28-20)14-29-22-25-24-21(27(22)18-7-8-18)26-10-4-3-5-11-26/h6,9,12-13,18H,3-5,7-8,10-11,14H2,1-2H3