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

Systemtic Name: methyl 4-chloranyl-3-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)amino]benzoate Openeye Name: methyl 4-chloro-3-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)amino]benzoate CAS Name: 4-chloro-3-[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)amino]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-3-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)amino]benzoate Traditional Name: 4-chloro-3-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acid methyl ester Formula: C16H14ClN3O2S MolecularWeight: 347.81926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NC3=C(C=CC(=C3)C(=O)OC)Cl)C

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NC3=C(C=CC(=C3)C(=O)OC)Cl)C

InChI

InChI=1S/C16H14ClN3O2S/c1-8-9(2)23-15-13(8)14(18-7-19-15)20-12-6-10(16(21)22-3)4-5-11(12)17/h4-7H,1-3H3,(H,18,19,20)