3-[(2-chlorophenyl)methyl]-N-(4-iodophenyl)-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 3-[(2-chlorophenyl)methyl]-N-(4-iodophenyl)-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 3-[(2-chlorophenyl)methyl]-N-(4-iodophenyl)-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 3-[(2-chlorophenyl)methyl]-N-(4-iodophenyl)-5-methyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 3-[(2-chlorophenyl)methyl]-N-(4-iodophenyl)-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 3-(2-chlorobenzyl)-N-(4-iodophenyl)-4-keto-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C21H15ClIN3O2S MolecularWeight: 535.78517

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CC3=CC=CC=C3Cl)C(=O)NC4=CC=C(C=C4)I

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CC3=CC=CC=C3Cl)C(=O)NC4=CC=C(C=C4)I

InChI

InChI=1S/C21H15ClIN3O2S/c1-12-17-20(29-18(12)19(27)25-15-8-6-14(23)7-9-15)24-11-26(21(17)28)10-13-4-2-3-5-16(13)22/h2-9,11H,10H2,1H3,(H,25,27)