methyl 2-[4-[(3-fluoranyl-4-methyl-phenyl)amino]-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl]ethanoate

Systemtic Name: methyl 2-[4-[(3-fluoranyl-4-methyl-phenyl)amino]-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl]ethanoate Openeye Name: methyl 2-[4-(3-fluoro-4-methyl-anilino)-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl]acetate CAS Name: 2-[4-(3-fluoro-4-methylanilino)-5,6-dimethyl-2-thieno[2,3-d]pyrimidinyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-(3-fluoro-4-methylanilino)-5,6-dimethylthieno[2,3-d]pyrimidin-2-yl]acetate Traditional Name: 2-[4-(3-fluoro-4-methyl-anilino)-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl]acetic acid methyl ester Formula: C18H18FN3O2S MolecularWeight: 359.417823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=C3C(=C(SC3=NC(=N2)CC(=O)OC)C)C)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=C3C(=C(SC3=NC(=N2)CC(=O)OC)C)C)F

InChI

InChI=1S/C18H18FN3O2S/c1-9-5-6-12(7-13(9)19)20-17-16-10(2)11(3)25-18(16)22-14(21-17)8-15(23)24-4/h5-7H,8H2,1-4H3,(H,20,21,22)