5-chloranyl-4-[[5-(4-ethoxyphenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-yl]amino]-2-methoxy-benzoate

Systemtic Name: 5-chloranyl-4-[[5-(4-ethoxyphenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-yl]amino]-2-methoxy-benzoate Openeye Name: 5-chloro-4-[[5-(4-ethoxyphenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-yl]amino]-2-methoxy-benzoate CAS Name: 5-chloro-4-[[5-(4-ethoxyphenyl)-6-methyl-4-thieno[2,3-d]pyrimidinyl]amino]-2-methoxybenzoate IUPAC Name: 5-chloro-4-[[5-(4-ethoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-yl]amino]-2-methoxybenzoate Traditional Name: 5-chloro-2-methoxy-4-[(6-methyl-5-p-phenetyl-thieno[2,3-d]pyrimidin-4-yl)amino]benzoate Formula: C23H19ClN3O4S- MolecularWeight: 468.93266

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=C(SC3=NC=NC(=C23)NC4=C(C=C(C(=C4)OC)C(=O)[O-])Cl)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=C(SC3=NC=NC(=C23)NC4=C(C=C(C(=C4)OC)C(=O)[O-])Cl)C

InChI

InChI=1S/C23H20ClN3O4S/c1-4-31-14-7-5-13(6-8-14)19-12(2)32-22-20(19)21(25-11-26-22)27-17-10-18(30-3)15(23(28)29)9-16(17)24/h5-11H,4H2,1-3H3,(H,28,29)(H,25,26,27)/p-1