5-chloranyl-2-methoxy-4-[[5-(4-propan-2-ylphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]benzoate

Systemtic Name: 5-chloranyl-2-methoxy-4-[[5-(4-propan-2-ylphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]benzoate Openeye Name: 5-chloro-4-[[5-(4-isopropylphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]-2-methoxy-benzoate CAS Name: 5-chloro-2-methoxy-4-[[5-(4-propan-2-ylphenyl)-4-thieno[2,3-d]pyrimidinyl]amino]benzoate IUPAC Name: 5-chloro-2-methoxy-4-[[5-(4-propan-2-ylphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]benzoate Traditional Name: 5-chloro-2-methoxy-4-[(5-p-cumenylthieno[2,3-d]pyrimidin-4-yl)amino]benzoate Formula: C23H19ClN3O3S- MolecularWeight: 452.93326

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=CSC3=NC=NC(=C23)NC4=C(C=C(C(=C4)OC)C(=O)[O-])Cl

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=CSC3=NC=NC(=C23)NC4=C(C=C(C(=C4)OC)C(=O)[O-])Cl

InChI

InChI=1S/C23H20ClN3O3S/c1-12(2)13-4-6-14(7-5-13)16-10-31-22-20(16)21(25-11-26-22)27-18-9-19(30-3)15(23(28)29)8-17(18)24/h4-12H,1-3H3,(H,28,29)(H,25,26,27)/p-1