N-[4-[[6-(dimethylamino)-2-methyl-pyrimidin-4-yl]amino]phenyl]-3-methyl-benzenesulfonamide

Systemtic Name: N-[4-[[6-(dimethylamino)-2-methyl-pyrimidin-4-yl]amino]phenyl]-3-methyl-benzenesulfonamide Openeye Name: N-[4-[[6-(dimethylamino)-2-methyl-pyrimidin-4-yl]amino]phenyl]-3-methyl-benzenesulfonamide CAS Name: N-[4-[[6-(dimethylamino)-2-methyl-4-pyrimidinyl]amino]phenyl]-3-methylbenzenesulfonamide IUPAC Name: N-[4-[[6-(dimethylamino)-2-methylpyrimidin-4-yl]amino]phenyl]-3-methylbenzenesulfonamide Traditional Name: N-[4-[[6-(dimethylamino)-2-methyl-pyrimidin-4-yl]amino]phenyl]-3-methyl-benzenesulfonamide Formula: C20H23N5O2S MolecularWeight: 397.49392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)S(=O)(=O)NC2=CC=C(C=C2)NC3=CC(=NC(=N3)C)N(C)C

Isomeric SMILES

CC1=CC(=CC=C1)S(=O)(=O)NC2=CC=C(C=C2)NC3=CC(=NC(=N3)C)N(C)C

InChI

InChI=1S/C20H23N5O2S/c1-14-6-5-7-18(12-14)28(26,27)24-17-10-8-16(9-11-17)23-19-13-20(25(3)4)22-15(2)21-19/h5-13,24H,1-4H3,(H,21,22,23)