4-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-(2,3-dimethoxyphenyl)-1,3-thiazole

Systemtic Name: 4-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-(2,3-dimethoxyphenyl)-1,3-thiazole Openeye Name: 4-[[4-cyclopropyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-2-(2,3-dimethoxyphenyl)thiazole CAS Name: 4-[[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]methyl]-2-(2,3-dimethoxyphenyl)thiazole IUPAC Name: 4-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-(2,3-dimethoxyphenyl)-1,3-thiazole Traditional Name: 4-[[[4-cyclopropyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]methyl]-2-(2,3-dimethoxyphenyl)thiazole Formula: C22H21N5O2S2 MolecularWeight: 451.56444

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C2=NC(=CS2)CSC3=NN=C(N3C4CC4)C5=CC=NC=C5

Isomeric SMILES

COC1=CC=CC(=C1OC)C2=NC(=CS2)CSC3=NN=C(N3C4CC4)C5=CC=NC=C5

InChI

InChI=1S/C22H21N5O2S2/c1-28-18-5-3-4-17(19(18)29-2)21-24-15(12-30-21)13-31-22-26-25-20(27(22)16-6-7-16)14-8-10-23-11-9-14/h3-5,8-12,16H,6-7,13H2,1-2H3