4-[[5-azanyl-6-[ethyl-(3-methylphenyl)amino]pyrimidin-4-yl]amino]-N,N-diethyl-benzenesulfonamide

Systemtic Name: 4-[[5-azanyl-6-[ethyl-(3-methylphenyl)amino]pyrimidin-4-yl]amino]-N,N-diethyl-benzenesulfonamide Openeye Name: 4-[[5-amino-6-(N-ethyl-3-methyl-anilino)pyrimidin-4-yl]amino]-N,N-diethyl-benzenesulfonamide CAS Name: 4-[[5-amino-6-(N-ethyl-3-methylanilino)-4-pyrimidinyl]amino]-N,N-diethylbenzenesulfonamide IUPAC Name: 4-[[5-amino-6-(N-ethyl-3-methylanilino)pyrimidin-4-yl]amino]-N,N-diethylbenzenesulfonamide Traditional Name: 4-[[5-amino-6-(N-ethyl-3-methyl-anilino)pyrimidin-4-yl]amino]-N,N-diethyl-benzenesulfonamide Formula: C23H30N6O2S MolecularWeight: 454.5883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)NC2=C(C(=NC=N2)N(CC)C3=CC=CC(=C3)C)N

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)NC2=C(C(=NC=N2)N(CC)C3=CC=CC(=C3)C)N

InChI

InChI=1S/C23H30N6O2S/c1-5-28(6-2)32(30,31)20-13-11-18(12-14-20)27-22-21(24)23(26-16-25-22)29(7-3)19-10-8-9-17(4)15-19/h8-16H,5-7,24H2,1-4H3,(H,25,26,27)