N-(5-chloranyl-2-methoxy-phenyl)-5-methyl-4-oxidanylidene-3-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-5-methyl-4-oxidanylidene-3-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-5-methyl-4-oxo-3-(2-oxo-2-pyrrolidin-1-yl-ethyl)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(5-chloro-2-methoxyphenyl)-5-methyl-4-oxo-3-[2-oxo-2-(1-pyrrolidinyl)ethyl]-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-5-methyl-4-oxo-3-(2-oxo-2-pyrrolidin-1-ylethyl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-4-keto-3-(2-keto-2-pyrrolidino-ethyl)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C21H21ClN4O4S MolecularWeight: 460.93384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)N3CCCC3)C(=O)NC4=C(C=CC(=C4)Cl)OC

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)N3CCCC3)C(=O)NC4=C(C=CC(=C4)Cl)OC

InChI

InChI=1S/C21H21ClN4O4S/c1-12-17-20(23-11-26(21(17)29)10-16(27)25-7-3-4-8-25)31-18(12)19(28)24-14-9-13(22)5-6-15(14)30-2/h5-6,9,11H,3-4,7-8,10H2,1-2H3,(H,24,28)