3-chloranyl-N-[2-[(4-cyanophenyl)methylsulfanyl]phenyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[2-[(4-cyanophenyl)methylsulfanyl]phenyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[2-[(4-cyanophenyl)methylsulfanyl]phenyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[2-[(4-cyanophenyl)methylthio]phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[2-[(4-cyanophenyl)methylsulfanyl]phenyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[2-[(4-cyanobenzyl)thio]phenyl]benzothiophene-2-carboxamide Formula: C23H15ClN2OS2 MolecularWeight: 434.961

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)C(=O)NC3=CC=CC=C3SCC4=CC=C(C=C4)C#N)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)C(=O)NC3=CC=CC=C3SCC4=CC=C(C=C4)C#N)Cl

InChI

InChI=1S/C23H15ClN2OS2/c24-21-17-5-1-3-7-19(17)29-22(21)23(27)26-18-6-2-4-8-20(18)28-14-16-11-9-15(13-25)10-12-16/h1-12H,14H2,(H,26,27)