3,4,5-triethoxy-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)benzamide

Systemtic Name: 3,4,5-triethoxy-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)benzamide Openeye Name: 3,4,5-triethoxy-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)benzamide CAS Name: 3,4,5-triethoxy-N-[2-(methylthio)-1,3-benzothiazol-6-yl]benzamide IUPAC Name: 3,4,5-triethoxy-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)benzamide Traditional Name: 3,4,5-triethoxy-N-[2-(methylthio)-1,3-benzothiazol-6-yl]benzamide Formula: C21H24N2O4S2 MolecularWeight: 432.55626

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=CC3=C(C=C2)N=C(S3)SC

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=CC3=C(C=C2)N=C(S3)SC

InChI

InChI=1S/C21H24N2O4S2/c1-5-25-16-10-13(11-17(26-6-2)19(16)27-7-3)20(24)22-14-8-9-15-18(12-14)29-21(23-15)28-4/h8-12H,5-7H2,1-4H3,(H,22,24)