carbanide; copper; N-[2-[3-[1-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-2,4-bis(oxidanylidene)pyrimidin-5-yl]propanoylamino]ethyl]-4-[2-(4-methylpyridin-2-yl)pyridin-4-yl]butanamide; hydrate

Systemtic Name: carbanide; copper; N-[2-[3-[1-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-2,4-bis(oxidanylidene)pyrimidin-5-yl]propanoylamino]ethyl]-4-[2-(4-methylpyridin-2-yl)pyridin-4-yl]butanamide; hydrate Openeye Name: carbanide; copper; N-[2-[3-[1-[4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-2,4-dioxo-pyrimidin-5-yl]propanoylamino]ethyl]-4-[2-(4-methyl-2-pyridyl)-4-pyridyl]butanamide; hydrate CAS Name: carbanide; copper; N-[2-[[3-[1-[4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-2,4-dioxo-5-pyrimidinyl]-1-oxopropyl]amino]ethyl]-4-[2-(4-methyl-2-pyridinyl)-4-pyridinyl]butanamide; hydrate IUPAC Name: carbanide; copper; N-[2-[3-[1-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2,4-dioxopyrimidin-5-yl]propanoylamino]ethyl]-4-[2-(4-methylpyridin-2-yl)pyridin-4-yl]butanamide; hydrate Traditional Name: carbanide; copper; N-[2-[3-[1-(4-hydroxy-5-methylol-tetrahydrofuran-2-yl)-2,4-diketo-pyrimidin-5-yl]propanoylamino]ethyl]-4-[2-(4-methyl-2-pyridyl)-4-pyridyl]butyramide; hydrate Formula: C30H41CuN6O8- MolecularWeight: 677.22794

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Descriptors Computed from Structure

Canonical SMILES:

[CH3-].CC1=CC(=NC=C1)C2=NC=CC(=C2)CCCC(=O)NCCNC(=O)CCC3=CN(C(=O)NC3=O)C4CC(C(O4)CO)O.O.[Cu]

Isomeric SMILES

[CH3-].CC1=CC(=NC=C1)C2=NC=CC(=C2)CCCC(=O)NCCNC(=O)CCC3=CN(C(=O)NC3=O)C4CC(C(O4)CO)O.O.[Cu]

InChI

InChI=1S/C29H36N6O7.CH3.Cu.H2O/c1-18-7-9-30-21(13-18)22-14-19(8-10-31-22)3-2-4-25(38)32-11-12-33-26(39)6-5-20-16-35(29(41)34-28(20)40)27-15-23(37)24(17-36)42-27;;;/h7-10,13-14,16,23-24,27,36-37H,2-6,11-12,15,17H2,1H3,(H,32,38)(H,33,39)(H,34,40,41);1H3;;1H2/q;-1;;