N-[3-chloranyl-4-[cyano(phenyl)methyl]phenyl]-2,3-dihydro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[3-chloranyl-4-[cyano(phenyl)methyl]phenyl]-2,3-dihydro-1-benzothiophene-2-carboxamide Openeye Name: N-[3-chloro-4-[cyano(phenyl)methyl]phenyl]-2,3-dihydrobenzothiophene-2-carboxamide CAS Name: N-[3-chloro-4-[cyano(phenyl)methyl]phenyl]-2,3-dihydro-1-benzothiophene-2-carboxamide IUPAC Name: N-[3-chloro-4-[cyano(phenyl)methyl]phenyl]-2,3-dihydro-1-benzothiophene-2-carboxamide Traditional Name: N-[3-chloro-4-[cyano(phenyl)methyl]phenyl]-2,3-dihydrobenzothiophene-2-carboxamide Formula: C23H17ClN2OS MolecularWeight: 404.91188

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Descriptors Computed from Structure

Canonical SMILES:

C1C(SC2=CC=CC=C21)C(=O)NC3=CC(=C(C=C3)C(C#N)C4=CC=CC=C4)Cl

Isomeric SMILES

C1C(SC2=CC=CC=C21)C(=O)NC3=CC(=C(C=C3)C(C#N)C4=CC=CC=C4)Cl

InChI

InChI=1S/C23H17ClN2OS/c24-20-13-17(10-11-18(20)19(14-25)15-6-2-1-3-7-15)26-23(27)22-12-16-8-4-5-9-21(16)28-22/h1-11,13,19,22H,12H2,(H,26,27)