2-[[4-(3-ethoxypropyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzothiazole

Systemtic Name: 2-[[4-(3-ethoxypropyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzothiazole Openeye Name: 2-[[4-(3-ethoxypropyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzothiazole CAS Name: 2-[[[4-(3-ethoxypropyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]thio]methyl]-1,3-benzothiazole IUPAC Name: 2-[[4-(3-ethoxypropyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzothiazole Traditional Name: 2-[[[4-(3-ethoxypropyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]methyl]-1,3-benzothiazole Formula: C20H21N5OS2 MolecularWeight: 411.54364

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN1C(=NN=C1SCC2=NC3=CC=CC=C3S2)C4=CC=NC=C4

Isomeric SMILES

CCOCCCN1C(=NN=C1SCC2=NC3=CC=CC=C3S2)C4=CC=NC=C4

InChI

InChI=1S/C20H21N5OS2/c1-2-26-13-5-12-25-19(15-8-10-21-11-9-15)23-24-20(25)27-14-18-22-16-6-3-4-7-17(16)28-18/h3-4,6-11H,2,5,12-14H2,1H3