ethyl 4-azanyl-5-methyl-2-[(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylmethyl]thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 4-azanyl-5-methyl-2-[(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylmethyl]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-amino-5-methyl-2-[(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylmethyl]thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-amino-5-methyl-2-[[(4-methyl-6-phenyl-2-pyrimidinyl)thio]methyl]-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-5-methyl-2-[(4-methyl-6-phenylpyrimidin-2-yl)sulfanylmethyl]thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-amino-5-methyl-2-[[(4-methyl-6-phenyl-pyrimidin-2-yl)thio]methyl]thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C22H21N5O2S2 MolecularWeight: 451.56444

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)CSC3=NC(=CC(=N3)C)C4=CC=CC=C4)N)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)CSC3=NC(=CC(=N3)C)C4=CC=CC=C4)N)C

InChI

InChI=1S/C22H21N5O2S2/c1-4-29-21(28)18-13(3)17-19(23)26-16(27-20(17)31-18)11-30-22-24-12(2)10-15(25-22)14-8-6-5-7-9-14/h5-10H,4,11H2,1-3H3,(H2,23,26,27)