3-chloranyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[4-(3-pyridylmethylsulfanyl)phenyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[4-(3-pyridinylmethylthio)phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[4-(3-pyridylmethylthio)phenyl]benzothiophene-2-carboxamide Formula: C21H15ClN2OS2 MolecularWeight: 410.9396

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)C(=O)NC3=CC=C(C=C3)SCC4=CN=CC=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)C(=O)NC3=CC=C(C=C3)SCC4=CN=CC=C4)Cl

InChI

InChI=1S/C21H15ClN2OS2/c22-19-17-5-1-2-6-18(17)27-20(19)21(25)24-15-7-9-16(10-8-15)26-13-14-4-3-11-23-12-14/h1-12H,13H2,(H,24,25)