N-[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-3-chloranyl-1-benzothiophene-2-carboxamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-3-chloranyl-1-benzothiophene-2-carboxamide Openeye Name: N-[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-3-chloro-benzothiophene-2-carboxamide CAS Name: N-[2-[(1,3-benzodioxol-5-ylmethylamino)-oxomethyl]phenyl]-3-chloro-1-benzothiophene-2-carboxamide IUPAC Name: N-[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-3-chloro-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[2-(piperonylcarbamoyl)phenyl]benzothiophene-2-carboxamide Formula: C24H17ClN2O4S MolecularWeight: 464.92078

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC=CC=C3NC(=O)C4=C(C5=CC=CC=C5S4)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC=CC=C3NC(=O)C4=C(C5=CC=CC=C5S4)Cl

InChI

InChI=1S/C24H17ClN2O4S/c25-21-16-6-2-4-8-20(16)32-22(21)24(29)27-17-7-3-1-5-15(17)23(28)26-12-14-9-10-18-19(11-14)31-13-30-18/h1-11H,12-13H2,(H,26,28)(H,27,29)