3-chloranyl-5,6,7-trimethoxy-N-[3-[methyl(phenyl)amino]propyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-5,6,7-trimethoxy-N-[3-[methyl(phenyl)amino]propyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-5,6,7-trimethoxy-N-[3-(N-methylanilino)propyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-5,6,7-trimethoxy-N-[3-(N-methylanilino)propyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-5,6,7-trimethoxy-N-[3-(N-methylanilino)propyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-5,6,7-trimethoxy-N-[3-(N-methylanilino)propyl]benzothiophene-2-carboxamide Formula: C22H25ClN2O4S MolecularWeight: 448.9629

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC(=O)C1=C(C2=CC(=C(C(=C2S1)OC)OC)OC)Cl)C3=CC=CC=C3

Isomeric SMILES

CN(CCCNC(=O)C1=C(C2=CC(=C(C(=C2S1)OC)OC)OC)Cl)C3=CC=CC=C3

InChI

InChI=1S/C22H25ClN2O4S/c1-25(14-9-6-5-7-10-14)12-8-11-24-22(26)21-17(23)15-13-16(27-2)18(28-3)19(29-4)20(15)30-21/h5-7,9-10,13H,8,11-12H2,1-4H3,(H,24,26)