2-[3,7-dimethyl-1-(2-methylpropyl)-2,4-bis(oxidanylidene)pyrimido[4,5-d]pyrimidin-5-yl]sulfanyl-N-(4-methyl-1,3-thiazol-2-yl)ethanamide

Systemtic Name: 2-[3,7-dimethyl-1-(2-methylpropyl)-2,4-bis(oxidanylidene)pyrimido[4,5-d]pyrimidin-5-yl]sulfanyl-N-(4-methyl-1,3-thiazol-2-yl)ethanamide Openeye Name: 2-(1-isobutyl-3,7-dimethyl-2,4-dioxo-pyrimido[4,5-d]pyrimidin-5-yl)sulfanyl-N-(4-methylthiazol-2-yl)acetamide CAS Name: 2-[[3,7-dimethyl-1-(2-methylpropyl)-2,4-dioxo-5-pyrimido[4,5-d]pyrimidinyl]thio]-N-(4-methyl-2-thiazolyl)acetamide IUPAC Name: 2-[3,7-dimethyl-1-(2-methylpropyl)-2,4-dioxopyrimido[4,5-d]pyrimidin-5-yl]sulfanyl-N-(4-methyl-1,3-thiazol-2-yl)acetamide Traditional Name: 2-[(1-isobutyl-2,4-diketo-3,7-dimethyl-pyrimido[4,5-d]pyrimidin-5-yl)thio]-N-(4-methylthiazol-2-yl)acetamide Formula: C18H22N6O3S2 MolecularWeight: 434.53568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)NC(=O)CSC2=NC(=NC3=C2C(=O)N(C(=O)N3CC(C)C)C)C

Isomeric SMILES

CC1=CSC(=N1)NC(=O)CSC2=NC(=NC3=C2C(=O)N(C(=O)N3CC(C)C)C)C

InChI

InChI=1S/C18H22N6O3S2/c1-9(2)6-24-14-13(16(26)23(5)18(24)27)15(21-11(4)20-14)28-8-12(25)22-17-19-10(3)7-29-17/h7,9H,6,8H2,1-5H3,(H,19,22,25)