2-[[3-methyl-4-(2-methylpropoxy)pyridin-2-yl]methylsulfanyl]-1,3-benzothiazole

Systemtic Name: 2-[[3-methyl-4-(2-methylpropoxy)pyridin-2-yl]methylsulfanyl]-1,3-benzothiazole Openeye Name: 2-[(4-isobutoxy-3-methyl-2-pyridyl)methylsulfanyl]-1,3-benzothiazole CAS Name: 2-[[3-methyl-4-(2-methylpropoxy)-2-pyridinyl]methylthio]-1,3-benzothiazole IUPAC Name: 2-[[3-methyl-4-(2-methylpropoxy)pyridin-2-yl]methylsulfanyl]-1,3-benzothiazole Traditional Name: 2-[(4-isobutoxy-3-methyl-2-pyridyl)methylthio]-1,3-benzothiazole Formula: C18H20N2OS2 MolecularWeight: 344.4942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1CSC2=NC3=CC=CC=C3S2)OCC(C)C

Isomeric SMILES

CC1=C(C=CN=C1CSC2=NC3=CC=CC=C3S2)OCC(C)C

InChI

InChI=1S/C18H20N2OS2/c1-12(2)10-21-16-8-9-19-15(13(16)3)11-22-18-20-14-6-4-5-7-17(14)23-18/h4-9,12H,10-11H2,1-3H3