4-(4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)butyl (2E,4E)-hexa-2,4-dienoate

Systemtic Name: 4-(4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)butyl (2E,4E)-hexa-2,4-dienoate Openeye Name: 4-(4-oxo-2-thioxo-1H-pyrimidin-5-yl)butyl (2E,4E)-hexa-2,4-dienoate CAS Name: (2E,4E)-hexa-2,4-dienoic acid 4-(4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)butyl ester IUPAC Name: 4-(4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)butyl (2E,4E)-hexa-2,4-dienoate Traditional Name: (2E,4E)-hexa-2,4-dienoic acid 4-(4-keto-2-thioxo-1H-pyrimidin-5-yl)butyl ester Formula: C14H18N2O3S MolecularWeight: 294.36932

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC=CC(=O)OCCCCC1=CNC(=S)NC1=O

Isomeric SMILES

C/C=C/C=C/C(=O)OCCCCC1=CNC(=S)NC1=O

InChI

InChI=1S/C14H18N2O3S/c1-2-3-4-8-12(17)19-9-6-5-7-11-10-15-14(20)16-13(11)18/h2-4,8,10H,5-7,9H2,1H3,(H2,15,16,18,20)/b3-2+,8-4+