2-[(5-butyl-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-[(E)-(4-fluorophenyl)methylideneamino]ethanamide

Systemtic Name: 2-[(5-butyl-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-[(E)-(4-fluorophenyl)methylideneamino]ethanamide Openeye Name: 2-[(5-butyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-[(E)-(4-fluorophenyl)methyleneamino]acetamide CAS Name: 2-[(5-butyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)thio]-N-[(E)-(4-fluorophenyl)methylideneamino]acetamide IUPAC Name: 2-[(5-butyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-[(E)-(4-fluorophenyl)methylideneamino]acetamide Traditional Name: 2-[(5-butyl-4-keto-6-methyl-1H-pyrimidin-2-yl)thio]-N-[(E)-(4-fluorobenzylidene)amino]acetamide Formula: C18H21FN4O2S MolecularWeight: 376.448343

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(NC(=NC1=O)SCC(=O)NN=CC2=CC=C(C=C2)F)C

Isomeric SMILES

CCCCC1=C(NC(=NC1=O)SCC(=O)N/N=C/C2=CC=C(C=C2)F)C

InChI

InChI=1S/C18H21FN4O2S/c1-3-4-5-15-12(2)21-18(22-17(15)25)26-11-16(24)23-20-10-13-6-8-14(19)9-7-13/h6-10H,3-5,11H2,1-2H3,(H,23,24)(H,21,22,25)/b20-10+