2-[(3-ethanoylphenyl)amino]-6-methyl-5-octyl-1H-pyrimidin-4-one

Systemtic Name: 2-[(3-ethanoylphenyl)amino]-6-methyl-5-octyl-1H-pyrimidin-4-one Openeye Name: 2-(3-acetylanilino)-6-methyl-5-octyl-1H-pyrimidin-4-one CAS Name: 2-(3-acetylanilino)-6-methyl-5-octyl-1H-pyrimidin-4-one IUPAC Name: 2-(3-acetylanilino)-6-methyl-5-octyl-1H-pyrimidin-4-one Traditional Name: 2-(3-acetylanilino)-6-methyl-5-octyl-1H-pyrimidin-4-one Formula: C21H29N3O2 MolecularWeight: 355.47386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(NC(=NC1=O)NC2=CC=CC(=C2)C(=O)C)C

Isomeric SMILES

CCCCCCCCC1=C(NC(=NC1=O)NC2=CC=CC(=C2)C(=O)C)C

InChI

InChI=1S/C21H29N3O2/c1-4-5-6-7-8-9-13-19-15(2)22-21(24-20(19)26)23-18-12-10-11-17(14-18)16(3)25/h10-12,14H,4-9,13H2,1-3H3,(H2,22,23,24,26)