N6,N6-dimethyl-N4-[1-(phenylsulfonyl)indol-5-yl]pyrido[3,4-d]pyrimidine-4,6-diamine

Systemtic Name: N6,N6-dimethyl-N4-[1-(phenylsulfonyl)indol-5-yl]pyrido[3,4-d]pyrimidine-4,6-diamine Openeye Name: N4-[1-(benzenesulfonyl)indol-5-yl]-N6,N6-dimethyl-pyrido[3,4-d]pyrimidine-4,6-diamine CAS Name: N4-[1-(benzenesulfonyl)-5-indolyl]-N6,N6-dimethylpyrido[3,4-d]pyrimidine-4,6-diamine IUPAC Name: 4-N-[1-(benzenesulfonyl)indol-5-yl]-6-N,6-N-dimethylpyrido[3,4-d]pyrimidine-4,6-diamine Traditional Name: [4-[(1-besylindol-5-yl)amino]pyrido[3,4-d]pyrimidin-6-yl]-dimethyl-amine Formula: C23H20N6O2S MolecularWeight: 444.5089

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC=C2C(=C1)C(=NC=N2)NC3=CC4=C(C=C3)N(C=C4)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CN(C)C1=NC=C2C(=C1)C(=NC=N2)NC3=CC4=C(C=C3)N(C=C4)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C23H20N6O2S/c1-28(2)22-13-19-20(14-24-22)25-15-26-23(19)27-17-8-9-21-16(12-17)10-11-29(21)32(30,31)18-6-4-3-5-7-18/h3-15H,1-2H3,(H,25,26,27)