N-[2-[(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)-phenyl-amino]ethyl]methanesulfonamide

Systemtic Name: N-[2-[(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)-phenyl-amino]ethyl]methanesulfonamide Openeye Name: N-[2-(N-(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)anilino)ethyl]methanesulfonamide CAS Name: N-[2-(N-(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl)anilino)ethyl]methanesulfonamide IUPAC Name: N-[2-(N-(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl)anilino)ethyl]methanesulfonamide Traditional Name: N-[2-(N-(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)anilino)ethyl]methanesulfonamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)N(CCNS(=O)(=O)C)C3=CC=CC=C3)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)N(CCNS(=O)(=O)C)C3=CC=CC=C3)O)C

InChI

InChI=1S/C21H25N3O4S/c1-21(2)20(25)19(17-13-15(14-22)9-10-18(17)28-21)24(12-11-23-29(3,26)27)16-7-5-4-6-8-16/h4-10,13,19-20,23,25H,11-12H2,1-3H3