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

Systemtic Name: 2-[1,7-dicyclopropyl-2,4-bis(oxidanylidene)pyrimido[4,5-d]pyrimidin-5-yl]sulfanyl-N-ethyl-propanamide Openeye Name: 2-(1,7-dicyclopropyl-2,4-dioxo-pyrimido[4,5-d]pyrimidin-5-yl)sulfanyl-N-ethyl-propanamide CAS Name: 2-[(1,7-dicyclopropyl-2,4-dioxo-5-pyrimido[4,5-d]pyrimidinyl)thio]-N-ethylpropanamide IUPAC Name: 2-(1,7-dicyclopropyl-2,4-dioxopyrimido[4,5-d]pyrimidin-5-yl)sulfanyl-N-ethylpropanamide Traditional Name: 2-[(1,7-dicyclopropyl-2,4-diketo-pyrimido[4,5-d]pyrimidin-5-yl)thio]-N-ethyl-propionamide Formula: C17H21N5O3S MolecularWeight: 375.44534

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)SC1=NC(=NC2=C1C(=O)NC(=O)N2C3CC3)C4CC4

Isomeric SMILES

CCNC(=O)C(C)SC1=NC(=NC2=C1C(=O)NC(=O)N2C3CC3)C4CC4

InChI

InChI=1S/C17H21N5O3S/c1-3-18-14(23)8(2)26-16-11-13(19-12(20-16)9-4-5-9)22(10-6-7-10)17(25)21-15(11)24/h8-10H,3-7H2,1-2H3,(H,18,23)(H,21,24,25)