2-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]-N-(4-phenyl-1,3-thiazol-2-yl)-N-prop-2-enyl-ethanamide

Systemtic Name: 2-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]-N-(4-phenyl-1,3-thiazol-2-yl)-N-prop-2-enyl-ethanamide Openeye Name: N-allyl-2-(3,7-dimethyl-2,6-dioxo-purin-1-yl)-N-(4-phenylthiazol-2-yl)acetamide CAS Name: 2-(3,7-dimethyl-2,6-dioxo-1-purinyl)-N-(4-phenyl-2-thiazolyl)-N-prop-2-enylacetamide IUPAC Name: 2-(3,7-dimethyl-2,6-dioxopurin-1-yl)-N-(4-phenyl-1,3-thiazol-2-yl)-N-prop-2-enylacetamide Traditional Name: N-allyl-2-(2,6-diketo-3,7-dimethyl-purin-1-yl)-N-(4-phenylthiazol-2-yl)acetamide Formula: C21H20N6O3S MolecularWeight: 436.4869

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C(=O)N(C(=O)N2C)CC(=O)N(CC=C)C3=NC(=CS3)C4=CC=CC=C4

Isomeric SMILES

CN1C=NC2=C1C(=O)N(C(=O)N2C)CC(=O)N(CC=C)C3=NC(=CS3)C4=CC=CC=C4

InChI

InChI=1S/C21H20N6O3S/c1-4-10-26(20-23-15(12-31-20)14-8-6-5-7-9-14)16(28)11-27-19(29)17-18(22-13-24(17)2)25(3)21(27)30/h4-9,12-13H,1,10-11H2,2-3H3