3-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]propanamide

Systemtic Name: 3-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]propanamide Openeye Name: 3-(2,4-dioxopyrimidin-1-yl)-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]propanamide CAS Name: 3-(2,4-dioxo-1-pyrimidinyl)-N-[3-[6-(1-pyrrolidinyl)-3-pyridazinyl]phenyl]propanamide IUPAC Name: 3-(2,4-dioxopyrimidin-1-yl)-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]propanamide Traditional Name: 3-(2,4-diketopyrimidin-1-yl)-N-[3-(6-pyrrolidinopyridazin-3-yl)phenyl]propionamide Formula: C21H22N6O3 MolecularWeight: 406.43778

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NN=C(C=C2)C3=CC(=CC=C3)NC(=O)CCN4C=CC(=O)NC4=O

Isomeric SMILES

C1CCN(C1)C2=NN=C(C=C2)C3=CC(=CC=C3)NC(=O)CCN4C=CC(=O)NC4=O

InChI

InChI=1S/C21H22N6O3/c28-19(8-12-27-13-9-20(29)23-21(27)30)22-16-5-3-4-15(14-16)17-6-7-18(25-24-17)26-10-1-2-11-26/h3-7,9,13-14H,1-2,8,10-12H2,(H,22,28)(H,23,29,30)