N-[2-[[6-(dimethylamino)-2-methyl-pyrimidin-4-yl]amino]ethyl]-1,2-dihydroacenaphthylene-3-sulfonamide

Systemtic Name: N-[2-[[6-(dimethylamino)-2-methyl-pyrimidin-4-yl]amino]ethyl]-1,2-dihydroacenaphthylene-3-sulfonamide Openeye Name: N-[2-[[6-(dimethylamino)-2-methyl-pyrimidin-4-yl]amino]ethyl]-1,2-dihydroacenaphthylene-3-sulfonamide CAS Name: N-[2-[[6-(dimethylamino)-2-methyl-4-pyrimidinyl]amino]ethyl]-1,2-dihydroacenaphthylene-3-sulfonamide IUPAC Name: N-[2-[[6-(dimethylamino)-2-methylpyrimidin-4-yl]amino]ethyl]-1,2-dihydroacenaphthylene-3-sulfonamide Traditional Name: N-[2-[[6-(dimethylamino)-2-methyl-pyrimidin-4-yl]amino]ethyl]acenaphthene-3-sulfonamide Formula: C21H25N5O2S MolecularWeight: 411.5205

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)N(C)C)NCCNS(=O)(=O)C2=C3CCC4=CC=CC(=C43)C=C2

Isomeric SMILES

CC1=NC(=CC(=N1)N(C)C)NCCNS(=O)(=O)C2=C3CCC4=CC=CC(=C43)C=C2

InChI

InChI=1S/C21H25N5O2S/c1-14-24-19(13-20(25-14)26(2)3)22-11-12-23-29(27,28)18-10-8-16-6-4-5-15-7-9-17(18)21(15)16/h4-6,8,10,13,23H,7,9,11-12H2,1-3H3,(H,22,24,25)