N3-(4-iodanyl-2-methyl-phenyl)-7-methyl-5-oxidanylidene-N2-phenyl-[1,3]thiazolo[3,2-a]pyrimidine-2,3-dicarboxamide

Systemtic Name: N3-(4-iodanyl-2-methyl-phenyl)-7-methyl-5-oxidanylidene-N2-phenyl-[1,3]thiazolo[3,2-a]pyrimidine-2,3-dicarboxamide Openeye Name: N3-(4-iodo-2-methyl-phenyl)-7-methyl-5-oxo-N2-phenyl-thiazolo[3,2-a]pyrimidine-2,3-dicarboxamide CAS Name: N3-(4-iodo-2-methylphenyl)-7-methyl-5-oxo-N2-phenylthiazolo[3,2-a]pyrimidine-2,3-dicarboxamide IUPAC Name: 3-N-(4-iodo-2-methylphenyl)-7-methyl-5-oxo-2-N-phenyl-[1,3]thiazolo[3,2-a]pyrimidine-2,3-dicarboxamide Traditional Name: N'-(4-iodo-2-methyl-phenyl)-5-keto-7-methyl-N-phenyl-thiazolo[3,2-a]pyrimidine-2,3-dicarboxamide Formula: C22H17IN4O3S MolecularWeight: 544.36485

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N2C(=C(SC2=N1)C(=O)NC3=CC=CC=C3)C(=O)NC4=C(C=C(C=C4)I)C

Isomeric SMILES

CC1=CC(=O)N2C(=C(SC2=N1)C(=O)NC3=CC=CC=C3)C(=O)NC4=C(C=C(C=C4)I)C

InChI

InChI=1S/C22H17IN4O3S/c1-12-10-14(23)8-9-16(12)26-20(29)18-19(21(30)25-15-6-4-3-5-7-15)31-22-24-13(2)11-17(28)27(18)22/h3-11H,1-2H3,(H,25,30)(H,26,29)