3,6-bis(chloranyl)-N-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3,6-bis(chloranyl)-N-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]-1-benzothiophene-2-carboxamide Openeye Name: 3,6-dichloro-N-[2-(3-pyridylmethylcarbamoyl)phenyl]benzothiophene-2-carboxamide CAS Name: 3,6-dichloro-N-[2-[oxo-(3-pyridinylmethylamino)methyl]phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3,6-dichloro-N-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]-1-benzothiophene-2-carboxamide Traditional Name: 3,6-dichloro-N-[2-(3-pyridylmethylcarbamoyl)phenyl]benzothiophene-2-carboxamide Formula: C22H15Cl2N3O2S MolecularWeight: 456.3444

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NCC2=CN=CC=C2)NC(=O)C3=C(C4=C(S3)C=C(C=C4)Cl)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NCC2=CN=CC=C2)NC(=O)C3=C(C4=C(S3)C=C(C=C4)Cl)Cl

InChI

InChI=1S/C22H15Cl2N3O2S/c23-14-7-8-16-18(10-14)30-20(19(16)24)22(29)27-17-6-2-1-5-15(17)21(28)26-12-13-4-3-9-25-11-13/h1-11H,12H2,(H,26,28)(H,27,29)