4-butoxy-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: 4-butoxy-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: 4-butoxy-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide CAS Name: 4-butoxy-N-[4-(methylthio)-1,3-benzothiazol-2-yl]benzamide IUPAC Name: 4-butoxy-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: 4-butoxy-N-[4-(methylthio)-1,3-benzothiazol-2-yl]benzamide Formula: C19H20N2O2S2 MolecularWeight: 372.5043

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC2=NC3=C(S2)C=CC=C3SC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC2=NC3=C(S2)C=CC=C3SC

InChI

InChI=1S/C19H20N2O2S2/c1-3-4-12-23-14-10-8-13(9-11-14)18(22)21-19-20-17-15(24-2)6-5-7-16(17)25-19/h5-11H,3-4,12H2,1-2H3,(H,20,21,22)