N-(4-iodophenyl)-5-methyl-3-[2-(3-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-(4-iodophenyl)-5-methyl-3-[2-(3-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(4-iodophenyl)-5-methyl-3-[2-(3-methyl-1-piperidyl)-2-oxo-ethyl]-4-oxo-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(4-iodophenyl)-5-methyl-3-[2-(3-methyl-1-piperidinyl)-2-oxoethyl]-4-oxo-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(4-iodophenyl)-5-methyl-3-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]-4-oxothieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(4-iodophenyl)-4-keto-3-[2-keto-2-(3-methylpiperidino)ethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C22H23IN4O3S MolecularWeight: 550.41249

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)CN2C=NC3=C(C2=O)C(=C(S3)C(=O)NC4=CC=C(C=C4)I)C

Isomeric SMILES

CC1CCCN(C1)C(=O)CN2C=NC3=C(C2=O)C(=C(S3)C(=O)NC4=CC=C(C=C4)I)C

InChI

InChI=1S/C22H23IN4O3S/c1-13-4-3-9-26(10-13)17(28)11-27-12-24-21-18(22(27)30)14(2)19(31-21)20(29)25-16-7-5-15(23)6-8-16/h5-8,12-13H,3-4,9-11H2,1-2H3,(H,25,29)