N-[4-azanyl-1-butyl-3-methyl-2,6-bis(oxidanylidene)pyrimidin-5-yl]-1-[(3-fluorophenyl)methyl]pyrazole-4-carboxamide

Systemtic Name: N-[4-azanyl-1-butyl-3-methyl-2,6-bis(oxidanylidene)pyrimidin-5-yl]-1-[(3-fluorophenyl)methyl]pyrazole-4-carboxamide Openeye Name: N-(4-amino-1-butyl-3-methyl-2,6-dioxo-pyrimidin-5-yl)-1-[(3-fluorophenyl)methyl]pyrazole-4-carboxamide CAS Name: N-(4-amino-1-butyl-3-methyl-2,6-dioxo-5-pyrimidinyl)-1-[(3-fluorophenyl)methyl]-4-pyrazolecarboxamide IUPAC Name: N-(4-amino-1-butyl-3-methyl-2,6-dioxopyrimidin-5-yl)-1-[(3-fluorophenyl)methyl]pyrazole-4-carboxamide Traditional Name: N-(4-amino-1-butyl-2,6-diketo-3-methyl-pyrimidin-5-yl)-1-(3-fluorobenzyl)pyrazole-4-carboxamide Formula: C20H23FN6O3 MolecularWeight: 414.433423

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(=C(N(C1=O)C)N)NC(=O)C2=CN(N=C2)CC3=CC(=CC=C3)F

Isomeric SMILES

CCCCN1C(=O)C(=C(N(C1=O)C)N)NC(=O)C2=CN(N=C2)CC3=CC(=CC=C3)F

InChI

InChI=1S/C20H23FN6O3/c1-3-4-8-27-19(29)16(17(22)25(2)20(27)30)24-18(28)14-10-23-26(12-14)11-13-6-5-7-15(21)9-13/h5-7,9-10,12H,3-4,8,11,22H2,1-2H3,(H,24,28)