1-cyano-1-[2-(dimethoxymethyl)-2-methyl-6-(methylsulfonylamino)-3-oxidanyl-3,4-dihydrochromen-4-yl]-2-(phenylmethyl)guanidine

Systemtic Name: 1-cyano-1-[2-(dimethoxymethyl)-2-methyl-6-(methylsulfonylamino)-3-oxidanyl-3,4-dihydrochromen-4-yl]-2-(phenylmethyl)guanidine Openeye Name: 2-benzyl-1-cyano-1-[2-(dimethoxymethyl)-3-hydroxy-6-(methanesulfonamido)-2-methyl-chroman-4-yl]guanidine CAS Name: 1-cyano-1-[2-(dimethoxymethyl)-3-hydroxy-6-(methanesulfonamido)-2-methyl-3,4-dihydro-2H-1-benzopyran-4-yl]-2-(phenylmethyl)guanidine IUPAC Name: 2-benzyl-1-cyano-1-[2-(dimethoxymethyl)-3-hydroxy-6-(methanesulfonamido)-2-methyl-3,4-dihydrochromen-4-yl]guanidine Traditional Name: 2-benzyl-1-cyano-1-[2-(dimethoxymethyl)-3-hydroxy-6-(methanesulfonamido)-2-methyl-chroman-4-yl]guanidine Formula: C23H29N5O6S MolecularWeight: 503.57126

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)NS(=O)(=O)C)N(C#N)C(=NCC3=CC=CC=C3)N)O)C(OC)OC

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)NS(=O)(=O)C)N(C#N)C(=NCC3=CC=CC=C3)N)O)C(OC)OC

InChI

InChI=1S/C23H29N5O6S/c1-23(21(32-2)33-3)20(29)19(17-12-16(27-35(4,30)31)10-11-18(17)34-23)28(14-24)22(25)26-13-15-8-6-5-7-9-15/h5-12,19-21,27,29H,13H2,1-4H3,(H2,25,26)