3-methoxy-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)-N-(2-thiophen-2-ylethyl)benzamide

Systemtic Name: 3-methoxy-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)-N-(2-thiophen-2-ylethyl)benzamide Openeye Name: 3-methoxy-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)-N-[2-(2-thienyl)ethyl]benzamide CAS Name: 3-methoxy-N-[4-(methylthio)-1,3-benzothiazol-2-yl]-N-(2-thiophen-2-ylethyl)benzamide IUPAC Name: 3-methoxy-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)-N-(2-thiophen-2-ylethyl)benzamide Traditional Name: 3-methoxy-N-[4-(methylthio)-1,3-benzothiazol-2-yl]-N-[2-(2-thienyl)ethyl]benzamide Formula: C22H20N2O2S3 MolecularWeight: 440.6014

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)N(CCC2=CC=CS2)C3=NC4=C(S3)C=CC=C4SC

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)N(CCC2=CC=CS2)C3=NC4=C(S3)C=CC=C4SC

InChI

InChI=1S/C22H20N2O2S3/c1-26-16-7-3-6-15(14-16)21(25)24(12-11-17-8-5-13-28-17)22-23-20-18(27-2)9-4-10-19(20)29-22/h3-10,13-14H,11-12H2,1-2H3