5-chloranyl-4-[(6-ethylthieno[2,3-d]pyrimidin-4-yl)amino]-2-methoxy-benzoic acid

Systemtic Name: 5-chloranyl-4-[(6-ethylthieno[2,3-d]pyrimidin-4-yl)amino]-2-methoxy-benzoic acid Openeye Name: 5-chloro-4-[(6-ethylthieno[2,3-d]pyrimidin-4-yl)amino]-2-methoxy-benzoic acid CAS Name: 5-chloro-4-[(6-ethyl-4-thieno[2,3-d]pyrimidinyl)amino]-2-methoxybenzoic acid IUPAC Name: 5-chloro-4-[(6-ethylthieno[2,3-d]pyrimidin-4-yl)amino]-2-methoxybenzoic acid Traditional Name: 5-chloro-4-[(6-ethylthieno[2,3-d]pyrimidin-4-yl)amino]-2-methoxy-benzoic acid Formula: C16H14ClN3O3S MolecularWeight: 363.81866

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N=CN=C2S1)NC3=C(C=C(C(=C3)OC)C(=O)O)Cl

Isomeric SMILES

CCC1=CC2=C(N=CN=C2S1)NC3=C(C=C(C(=C3)OC)C(=O)O)Cl

InChI

InChI=1S/C16H14ClN3O3S/c1-3-8-4-10-14(18-7-19-15(10)24-8)20-12-6-13(23-2)9(16(21)22)5-11(12)17/h4-7H,3H2,1-2H3,(H,21,22)(H,18,19,20)