4-[[5-(4-ethoxyphenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-yl]amino]-N-pyrimidin-2-yl-benzenesulfonamide

Systemtic Name: 4-[[5-(4-ethoxyphenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-yl]amino]-N-pyrimidin-2-yl-benzenesulfonamide Openeye Name: 4-[[5-(4-ethoxyphenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-yl]amino]-N-pyrimidin-2-yl-benzenesulfonamide CAS Name: 4-[[5-(4-ethoxyphenyl)-6-methyl-4-thieno[2,3-d]pyrimidinyl]amino]-N-(2-pyrimidinyl)benzenesulfonamide IUPAC Name: 4-[[5-(4-ethoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-yl]amino]-N-pyrimidin-2-ylbenzenesulfonamide Traditional Name: 4-[(6-methyl-5-p-phenetyl-thieno[2,3-d]pyrimidin-4-yl)amino]-N-(2-pyrimidyl)benzenesulfonamide Formula: C25H22N6O3S2 MolecularWeight: 518.61058

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=C(SC3=NC=NC(=C23)NC4=CC=C(C=C4)S(=O)(=O)NC5=NC=CC=N5)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=C(SC3=NC=NC(=C23)NC4=CC=C(C=C4)S(=O)(=O)NC5=NC=CC=N5)C

InChI

InChI=1S/C25H22N6O3S2/c1-3-34-19-9-5-17(6-10-19)21-16(2)35-24-22(21)23(28-15-29-24)30-18-7-11-20(12-8-18)36(32,33)31-25-26-13-4-14-27-25/h4-15H,3H2,1-2H3,(H,26,27,31)(H,28,29,30)