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

Systemtic Name: 4-[(4-cyclopropyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-(4-methylphenyl)-1,3-oxazole Openeye Name: 4-[[4-cyclopropyl-5-(1-piperidyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-2-(p-tolyl)oxazole CAS Name: 4-[[[4-cyclopropyl-5-(1-piperidinyl)-1,2,4-triazol-3-yl]thio]methyl]-2-(4-methylphenyl)oxazole IUPAC Name: 4-[(4-cyclopropyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-(4-methylphenyl)-1,3-oxazole Traditional Name: 4-[[(4-cyclopropyl-5-piperidino-1,2,4-triazol-3-yl)thio]methyl]-2-(p-tolyl)oxazole Formula: C21H25N5OS MolecularWeight: 395.5211

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N5OS/c1-15-5-7-16(8-6-15)19-22-17(13-27-19)14-28-21-24-23-20(26(21)18-9-10-18)25-11-3-2-4-12-25/h5-8,13,18H,2-4,9-12,14H2,1H3