N-(2-azanylethyl)-1-(3-fluorophenyl)carbonyl-3-(oxolan-2-ylcarbonyl)-1,3-diazinane-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-1-(3-fluorophenyl)carbonyl-3-(oxolan-2-ylcarbonyl)-1,3-diazinane-2-carboxamide Openeye Name: N-(2-aminoethyl)-1-(3-fluorobenzoyl)-3-(tetrahydrofuran-2-carbonyl)hexahydropyrimidine-2-carboxamide CAS Name: N-(2-aminoethyl)-1-[(3-fluorophenyl)-oxomethyl]-3-[oxo(2-oxolanyl)methyl]-1,3-diazinane-2-carboxamide IUPAC Name: N-(2-aminoethyl)-1-(3-fluorobenzoyl)-3-(oxolane-2-carbonyl)-1,3-diazinane-2-carboxamide Traditional Name: N-(2-aminoethyl)-1-(3-fluorobenzoyl)-3-(tetrahydrofuran-2-carbonyl)hexahydropyrimidine-2-carboxamide Formula: C19H25FN4O4 MolecularWeight: 392.424603

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)C(=O)N2CCCN(C2C(=O)NCCN)C(=O)C3=CC(=CC=C3)F

Isomeric SMILES

C1CC(OC1)C(=O)N2CCCN(C2C(=O)NCCN)C(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C19H25FN4O4/c20-14-5-1-4-13(12-14)18(26)23-9-3-10-24(17(23)16(25)22-8-7-21)19(27)15-6-2-11-28-15/h1,4-5,12,15,17H,2-3,6-11,21H2,(H,22,25)