(3R)-N-[6-azanyl-2,4-bis(oxidanylidene)-1-propyl-pyrimidin-5-yl]-N-butyl-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: (3R)-N-[6-azanyl-2,4-bis(oxidanylidene)-1-propyl-pyrimidin-5-yl]-N-butyl-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide Openeye Name: (3R)-N-(6-amino-2,4-dioxo-1-propyl-pyrimidin-5-yl)-N-butyl-1-oxo-isochromane-3-carboxamide CAS Name: (3R)-N-(6-amino-2,4-dioxo-1-propyl-5-pyrimidinyl)-N-butyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: (3R)-N-(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-N-butyl-1-oxo-3,4-dihydroisochromene-3-carboxamide Traditional Name: (3R)-N-(6-amino-2,4-diketo-1-propyl-pyrimidin-5-yl)-N-butyl-1-keto-isochroman-3-carboxamide Formula: C21H26N4O5 MolecularWeight: 414.45494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=C(N(C(=O)NC1=O)CCC)N)C(=O)C2CC3=CC=CC=C3C(=O)O2

Isomeric SMILES

CCCCN(C1=C(N(C(=O)NC1=O)CCC)N)C(=O)[C@H]2CC3=CC=CC=C3C(=O)O2

InChI

InChI=1S/C21H26N4O5/c1-3-5-11-24(16-17(22)25(10-4-2)21(29)23-18(16)26)19(27)15-12-13-8-6-7-9-14(13)20(28)30-15/h6-9,15H,3-5,10-12,22H2,1-2H3,(H,23,26,29)/t15-/m1/s1