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

Systemtic Name: 5-chloranyl-2-methoxy-4-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]benzoate Openeye Name: 5-chloro-2-methoxy-4-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]benzoate CAS Name: 5-chloro-2-methoxy-4-[(5-phenyl-4-thieno[2,3-d]pyrimidinyl)amino]benzoate IUPAC Name: 5-chloro-2-methoxy-4-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]benzoate Traditional Name: 5-chloro-2-methoxy-4-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]benzoate Formula: C20H13ClN3O3S- MolecularWeight: 410.85352

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)[O-])Cl)NC2=C3C(=CSC3=NC=N2)C4=CC=CC=C4

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)[O-])Cl)NC2=C3C(=CSC3=NC=N2)C4=CC=CC=C4

InChI

InChI=1S/C20H14ClN3O3S/c1-27-16-8-15(14(21)7-12(16)20(25)26)24-18-17-13(11-5-3-2-4-6-11)9-28-19(17)23-10-22-18/h2-10H,1H3,(H,25,26)(H,22,23,24)/p-1