ethyl 4-[(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 4-[(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-(2-chloro-5-morpholinosulfonyl-anilino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-[2-chloro-5-(4-morpholinylsulfonyl)anilino]-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-chloro-5-morpholin-4-ylsulfonylanilino)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-(2-chloro-5-morpholinosulfonyl-anilino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C20H21ClN4O5S2 MolecularWeight: 496.98754

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=CN=C2S1)NC3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=CN=C2S1)NC3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)Cl)C

InChI

InChI=1S/C20H21ClN4O5S2/c1-3-30-20(26)17-12(2)16-18(22-11-23-19(16)31-17)24-15-10-13(4-5-14(15)21)32(27,28)25-6-8-29-9-7-25/h4-5,10-11H,3,6-9H2,1-2H3,(H,22,23,24)