N-cyclohexyl-3-[1,7-dicyclopropyl-2,4-bis(oxidanylidene)pyrimido[4,5-d]pyrimidin-5-yl]sulfanyl-propanamide

Systemtic Name: N-cyclohexyl-3-[1,7-dicyclopropyl-2,4-bis(oxidanylidene)pyrimido[4,5-d]pyrimidin-5-yl]sulfanyl-propanamide Openeye Name: N-cyclohexyl-3-(1,7-dicyclopropyl-2,4-dioxo-pyrimido[4,5-d]pyrimidin-5-yl)sulfanyl-propanamide CAS Name: N-cyclohexyl-3-[(1,7-dicyclopropyl-2,4-dioxo-5-pyrimido[4,5-d]pyrimidinyl)thio]propanamide IUPAC Name: N-cyclohexyl-3-(1,7-dicyclopropyl-2,4-dioxopyrimido[4,5-d]pyrimidin-5-yl)sulfanylpropanamide Traditional Name: N-cyclohexyl-3-[(1,7-dicyclopropyl-2,4-diketo-pyrimido[4,5-d]pyrimidin-5-yl)thio]propionamide Formula: C21H27N5O3S MolecularWeight: 429.53578

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)CCSC2=NC(=NC3=C2C(=O)NC(=O)N3C4CC4)C5CC5

Isomeric SMILES

C1CCC(CC1)NC(=O)CCSC2=NC(=NC3=C2C(=O)NC(=O)N3C4CC4)C5CC5

InChI

InChI=1S/C21H27N5O3S/c27-15(22-13-4-2-1-3-5-13)10-11-30-20-16-18(23-17(24-20)12-6-7-12)26(14-8-9-14)21(29)25-19(16)28/h12-14H,1-11H2,(H,22,27)(H,25,28,29)