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

Systemtic Name: 5-chloranyl-2-methoxy-4-[(6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)amino]benzoate Openeye Name: 5-chloro-2-methoxy-4-[(6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)amino]benzoate CAS Name: 5-chloro-2-methoxy-4-[(6-methyl-5-phenyl-4-thieno[2,3-d]pyrimidinyl)amino]benzoate IUPAC Name: 5-chloro-2-methoxy-4-[(6-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]benzoate Traditional Name: 5-chloro-2-methoxy-4-[(6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)amino]benzoate Formula: C21H15ClN3O3S- MolecularWeight: 424.8801

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N=CN=C2S1)NC3=C(C=C(C(=C3)OC)C(=O)[O-])Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C2=C(N=CN=C2S1)NC3=C(C=C(C(=C3)OC)C(=O)[O-])Cl)C4=CC=CC=C4

InChI

InChI=1S/C21H16ClN3O3S/c1-11-17(12-6-4-3-5-7-12)18-19(23-10-24-20(18)29-11)25-15-9-16(28-2)13(21(26)27)8-14(15)22/h3-10H,1-2H3,(H,26,27)(H,23,24,25)/p-1