3-[2-[(3-chloranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-5-methyl-4-oxidanylidene-N-(4-phenoxyphenyl)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 3-[2-[(3-chloranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-5-methyl-4-oxidanylidene-N-(4-phenoxyphenyl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 3-[2-(3-chloro-4-methyl-anilino)-2-oxo-ethyl]-5-methyl-4-oxo-N-(4-phenoxyphenyl)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 3-[2-(3-chloro-4-methylanilino)-2-oxoethyl]-5-methyl-4-oxo-N-(4-phenoxyphenyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 3-[2-(3-chloro-4-methylanilino)-2-oxoethyl]-5-methyl-4-oxo-N-(4-phenoxyphenyl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 3-[2-(3-chloro-4-methyl-anilino)-2-keto-ethyl]-4-keto-5-methyl-N-(4-phenoxyphenyl)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C29H23ClN4O4S MolecularWeight: 559.03532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CN2C=NC3=C(C2=O)C(=C(S3)C(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CN2C=NC3=C(C2=O)C(=C(S3)C(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5)C)Cl

InChI

InChI=1S/C29H23ClN4O4S/c1-17-8-9-20(14-23(17)30)32-24(35)15-34-16-31-28-25(29(34)37)18(2)26(39-28)27(36)33-19-10-12-22(13-11-19)38-21-6-4-3-5-7-21/h3-14,16H,15H2,1-2H3,(H,32,35)(H,33,36)