3-(1,3-benzoxazol-2-ylsulfanylmethyl)-1-butyl-pyridin-2-one

Systemtic Name: 3-(1,3-benzoxazol-2-ylsulfanylmethyl)-1-butyl-pyridin-2-one Openeye Name: 3-(1,3-benzoxazol-2-ylsulfanylmethyl)-1-butyl-pyridin-2-one CAS Name: 3-[(1,3-benzoxazol-2-ylthio)methyl]-1-butyl-2-pyridinone IUPAC Name: 3-(1,3-benzoxazol-2-ylsulfanylmethyl)-1-butylpyridin-2-one Traditional Name: 3-[(1,3-benzoxazol-2-ylthio)methyl]-1-butyl-2-pyridone Formula: C17H18N2O2S MolecularWeight: 314.40202

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=CC=C(C1=O)CSC2=NC3=CC=CC=C3O2

Isomeric SMILES

CCCCN1C=CC=C(C1=O)CSC2=NC3=CC=CC=C3O2

InChI

InChI=1S/C17H18N2O2S/c1-2-3-10-19-11-6-7-13(16(19)20)12-22-17-18-14-8-4-5-9-15(14)21-17/h4-9,11H,2-3,10,12H2,1H3