7-chloranyl-N-[2-(4-methylsulfanylphenyl)ethyl]-4H-thieno[3,2-c]thiochromene-2-carboxamide

Systemtic Name: 7-chloranyl-N-[2-(4-methylsulfanylphenyl)ethyl]-4H-thieno[3,2-c]thiochromene-2-carboxamide Openeye Name: 7-chloro-N-[2-(4-methylsulfanylphenyl)ethyl]-4H-thieno[3,2-c]thiochromene-2-carboxamide CAS Name: 7-chloro-N-[2-[4-(methylthio)phenyl]ethyl]-4H-thieno[3,2-c]thiochromene-2-carboxamide IUPAC Name: 7-chloro-N-[2-(4-methylsulfanylphenyl)ethyl]-4H-thieno[3,2-c]thiochromene-2-carboxamide Traditional Name: 7-chloro-N-[2-[4-(methylthio)phenyl]ethyl]-4H-thieno[3,2-c]thiochromene-2-carboxamide Formula: C21H18ClNOS3 MolecularWeight: 432.02172

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CCNC(=O)C2=CC3=C(S2)C4=C(C=C(C=C4)Cl)SC3

Isomeric SMILES

CSC1=CC=C(C=C1)CCNC(=O)C2=CC3=C(S2)C4=C(C=C(C=C4)Cl)SC3

InChI

InChI=1S/C21H18ClNOS3/c1-25-16-5-2-13(3-6-16)8-9-23-21(24)19-10-14-12-26-18-11-15(22)4-7-17(18)20(14)27-19/h2-7,10-11H,8-9,12H2,1H3,(H,23,24)