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

Systemtic Name: N-tert-butyl-2-[1,7-dicyclopropyl-2,4-bis(oxidanylidene)pyrimido[4,5-d]pyrimidin-5-yl]sulfanyl-ethanamide Openeye Name: N-tert-butyl-2-(1,7-dicyclopropyl-2,4-dioxo-pyrimido[4,5-d]pyrimidin-5-yl)sulfanyl-acetamide CAS Name: N-tert-butyl-2-[(1,7-dicyclopropyl-2,4-dioxo-5-pyrimido[4,5-d]pyrimidinyl)thio]acetamide IUPAC Name: N-tert-butyl-2-(1,7-dicyclopropyl-2,4-dioxopyrimido[4,5-d]pyrimidin-5-yl)sulfanylacetamide Traditional Name: N-tert-butyl-2-[(1,7-dicyclopropyl-2,4-diketo-pyrimido[4,5-d]pyrimidin-5-yl)thio]acetamide Formula: C18H23N5O3S MolecularWeight: 389.47192

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CSC1=NC(=NC2=C1C(=O)NC(=O)N2C3CC3)C4CC4

Isomeric SMILES

CC(C)(C)NC(=O)CSC1=NC(=NC2=C1C(=O)NC(=O)N2C3CC3)C4CC4

InChI

InChI=1S/C18H23N5O3S/c1-18(2,3)22-11(24)8-27-16-12-14(19-13(20-16)9-4-5-9)23(10-6-7-10)17(26)21-15(12)25/h9-10H,4-8H2,1-3H3,(H,22,24)(H,21,25,26)