N-[(3-chlorophenyl)methyl]-3-(2,6-dimethyl-4-oxidanylidene-1H-pyrimidin-5-yl)propanamide

Systemtic Name: N-[(3-chlorophenyl)methyl]-3-(2,6-dimethyl-4-oxidanylidene-1H-pyrimidin-5-yl)propanamide Openeye Name: N-[(3-chlorophenyl)methyl]-3-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)propanamide CAS Name: N-[(3-chlorophenyl)methyl]-3-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)propanamide IUPAC Name: N-[(3-chlorophenyl)methyl]-3-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)propanamide Traditional Name: N-(3-chlorobenzyl)-3-(4-keto-2,6-dimethyl-1H-pyrimidin-5-yl)propionamide Formula: C16H18ClN3O2 MolecularWeight: 319.78602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)C)CCC(=O)NCC2=CC(=CC=C2)Cl

Isomeric SMILES

CC1=C(C(=O)N=C(N1)C)CCC(=O)NCC2=CC(=CC=C2)Cl

InChI

InChI=1S/C16H18ClN3O2/c1-10-14(16(22)20-11(2)19-10)6-7-15(21)18-9-12-4-3-5-13(17)8-12/h3-5,8H,6-7,9H2,1-2H3,(H,18,21)(H,19,20,22)