6-chloranyl-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-oxidanylidene-chromene-2-carboxamide

Systemtic Name: 6-chloranyl-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-oxidanylidene-chromene-2-carboxamide Openeye Name: 6-chloro-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-oxo-chromene-2-carboxamide CAS Name: 6-chloro-N-[2-[(2-cyanophenyl)methylthio]ethyl]-4-oxo-1-benzopyran-2-carboxamide IUPAC Name: 6-chloro-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-oxochromene-2-carboxamide Traditional Name: 6-chloro-N-[2-[(2-cyanobenzyl)thio]ethyl]-4-keto-chromene-2-carboxamide Formula: C20H15ClN2O3S MolecularWeight: 398.8627

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSCCNC(=O)C2=CC(=O)C3=C(O2)C=CC(=C3)Cl)C#N

Isomeric SMILES

C1=CC=C(C(=C1)CSCCNC(=O)C2=CC(=O)C3=C(O2)C=CC(=C3)Cl)C#N

InChI

InChI=1S/C20H15ClN2O3S/c21-15-5-6-18-16(9-15)17(24)10-19(26-18)20(25)23-7-8-27-12-14-4-2-1-3-13(14)11-22/h1-6,9-10H,7-8,12H2,(H,23,25)