3,4-dimethoxy-N-(2-phenacylsulfanyl-1,3-benzothiazol-6-yl)benzamide

Systemtic Name: 3,4-dimethoxy-N-(2-phenacylsulfanyl-1,3-benzothiazol-6-yl)benzamide Openeye Name: 3,4-dimethoxy-N-(2-phenacylsulfanyl-1,3-benzothiazol-6-yl)benzamide CAS Name: 3,4-dimethoxy-N-[2-(phenacylthio)-1,3-benzothiazol-6-yl]benzamide IUPAC Name: 3,4-dimethoxy-N-(2-phenacylsulfanyl-1,3-benzothiazol-6-yl)benzamide Traditional Name: 3,4-dimethoxy-N-[2-(phenacylthio)-1,3-benzothiazol-6-yl]benzamide Formula: C24H20N2O4S2 MolecularWeight: 464.5566

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)C4=CC=CC=C4)OC

InChI

InChI=1S/C24H20N2O4S2/c1-29-20-11-8-16(12-21(20)30-2)23(28)25-17-9-10-18-22(13-17)32-24(26-18)31-14-19(27)15-6-4-3-5-7-15/h3-13H,14H2,1-2H3,(H,25,28)