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

Systemtic Name: 2-[7-butyl-1,3-dimethyl-2,4-bis(oxidanylidene)pyrimido[4,5-d]pyrimidin-5-yl]sulfanyl-N-propyl-ethanamide Openeye Name: 2-(7-butyl-1,3-dimethyl-2,4-dioxo-pyrimido[4,5-d]pyrimidin-5-yl)sulfanyl-N-propyl-acetamide CAS Name: 2-[(7-butyl-1,3-dimethyl-2,4-dioxo-5-pyrimido[4,5-d]pyrimidinyl)thio]-N-propylacetamide IUPAC Name: 2-(7-butyl-1,3-dimethyl-2,4-dioxopyrimido[4,5-d]pyrimidin-5-yl)sulfanyl-N-propylacetamide Traditional Name: 2-[(7-butyl-2,4-diketo-1,3-dimethyl-pyrimido[4,5-d]pyrimidin-5-yl)thio]-N-propyl-acetamide Formula: C17H25N5O3S MolecularWeight: 379.4771

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(C(=N1)SCC(=O)NCCC)C(=O)N(C(=O)N2C)C

Isomeric SMILES

CCCCC1=NC2=C(C(=N1)SCC(=O)NCCC)C(=O)N(C(=O)N2C)C

InChI

InChI=1S/C17H25N5O3S/c1-5-7-8-11-19-14-13(16(24)22(4)17(25)21(14)3)15(20-11)26-10-12(23)18-9-6-2/h5-10H2,1-4H3,(H,18,23)