6-chloranyl-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2H-chromene-3-carboxamide

Systemtic Name: 6-chloranyl-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2H-chromene-3-carboxamide Openeye Name: 6-chloro-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2H-chromene-3-carboxamide CAS Name: 6-chloro-N-[2-[(2-cyanophenyl)methylthio]ethyl]-2H-1-benzopyran-3-carboxamide IUPAC Name: 6-chloro-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2H-chromene-3-carboxamide Traditional Name: 6-chloro-N-[2-[(2-cyanobenzyl)thio]ethyl]-2H-chromene-3-carboxamide Formula: C20H17ClN2O2S MolecularWeight: 384.87918

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=CC2=C(O1)C=CC(=C2)Cl)C(=O)NCCSCC3=CC=CC=C3C#N

Isomeric SMILES

C1C(=CC2=C(O1)C=CC(=C2)Cl)C(=O)NCCSCC3=CC=CC=C3C#N

InChI

InChI=1S/C20H17ClN2O2S/c21-18-5-6-19-16(10-18)9-17(12-25-19)20(24)23-7-8-26-13-15-4-2-1-3-14(15)11-22/h1-6,9-10H,7-8,12-13H2,(H,23,24)