N-aminocarbonyl-3-[7-tert-butyl-1,3-dimethyl-2,4-bis(oxidanylidene)pyrimido[4,5-d]pyrimidin-5-yl]sulfanyl-propanamide

Systemtic Name: N-aminocarbonyl-3-[7-tert-butyl-1,3-dimethyl-2,4-bis(oxidanylidene)pyrimido[4,5-d]pyrimidin-5-yl]sulfanyl-propanamide Openeye Name: 3-(7-tert-butyl-1,3-dimethyl-2,4-dioxo-pyrimido[4,5-d]pyrimidin-5-yl)sulfanyl-N-carbamoyl-propanamide CAS Name: 3-[(7-tert-butyl-1,3-dimethyl-2,4-dioxo-5-pyrimido[4,5-d]pyrimidinyl)thio]-N-carbamoylpropanamide IUPAC Name: 3-(7-tert-butyl-1,3-dimethyl-2,4-dioxopyrimido[4,5-d]pyrimidin-5-yl)sulfanyl-N-carbamoylpropanamide Traditional Name: 3-[(7-tert-butyl-2,4-diketo-1,3-dimethyl-pyrimido[4,5-d]pyrimidin-5-yl)thio]-N-carbamoyl-propionamide Formula: C16H22N6O4S MolecularWeight: 394.44868

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=C(C(=N1)SCCC(=O)NC(=O)N)C(=O)N(C(=O)N2C)C

Isomeric SMILES

CC(C)(C)C1=NC2=C(C(=N1)SCCC(=O)NC(=O)N)C(=O)N(C(=O)N2C)C

InChI

InChI=1S/C16H22N6O4S/c1-16(2,3)13-19-10-9(12(24)22(5)15(26)21(10)4)11(20-13)27-7-6-8(23)18-14(17)25/h6-7H2,1-5H3,(H3,17,18,23,25)