N-[6-cyano-8-(1H-imidazol-5-ylmethylamino)-3,4-dihydro-2H-chromen-3-yl]-N-(phenylmethyl)methanesulfonamide

Systemtic Name: N-[6-cyano-8-(1H-imidazol-5-ylmethylamino)-3,4-dihydro-2H-chromen-3-yl]-N-(phenylmethyl)methanesulfonamide Openeye Name: N-benzyl-N-[6-cyano-8-(1H-imidazol-5-ylmethylamino)chroman-3-yl]methanesulfonamide CAS Name: N-[6-cyano-8-(1H-imidazol-5-ylmethylamino)-3,4-dihydro-2H-1-benzopyran-3-yl]-N-(phenylmethyl)methanesulfonamide IUPAC Name: N-benzyl-N-[6-cyano-8-(1H-imidazol-5-ylmethylamino)-3,4-dihydro-2H-chromen-3-yl]methanesulfonamide Traditional Name: N-benzyl-N-[6-cyano-8-(1H-imidazol-5-ylmethylamino)chroman-3-yl]methanesulfonamide Formula: C22H23N5O3S MolecularWeight: 437.51472

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC1=CC=CC=C1)C2CC3=C(C(=CC(=C3)C#N)NCC4=CN=CN4)OC2

Isomeric SMILES

CS(=O)(=O)N(CC1=CC=CC=C1)C2CC3=C(C(=CC(=C3)C#N)NCC4=CN=CN4)OC2

InChI

InChI=1S/C22H23N5O3S/c1-31(28,29)27(13-16-5-3-2-4-6-16)20-9-18-7-17(10-23)8-21(22(18)30-14-20)25-12-19-11-24-15-26-19/h2-8,11,15,20,25H,9,12-14H2,1H3,(H,24,26)