2-[(4-butoxy-3-methyl-pyridin-2-yl)methylsulfinyl]-1,3-benzothiazole

Systemtic Name: 2-[(4-butoxy-3-methyl-pyridin-2-yl)methylsulfinyl]-1,3-benzothiazole Openeye Name: 2-[(4-butoxy-3-methyl-2-pyridyl)methylsulfinyl]-1,3-benzothiazole CAS Name: 2-[(4-butoxy-3-methyl-2-pyridinyl)methylsulfinyl]-1,3-benzothiazole IUPAC Name: 2-[(4-butoxy-3-methylpyridin-2-yl)methylsulfinyl]-1,3-benzothiazole Traditional Name: 2-[(4-butoxy-3-methyl-2-pyridyl)methylsulfinyl]-1,3-benzothiazole Formula: C18H20N2O2S2 MolecularWeight: 360.4936

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C(=NC=C1)CS(=O)C2=NC3=CC=CC=C3S2)C

Isomeric SMILES

CCCCOC1=C(C(=NC=C1)CS(=O)C2=NC3=CC=CC=C3S2)C

InChI

InChI=1S/C18H20N2O2S2/c1-3-4-11-22-16-9-10-19-15(13(16)2)12-24(21)18-20-14-7-5-6-8-17(14)23-18/h5-10H,3-4,11-12H2,1-2H3