6-[(4-ethenylphenyl)methoxy]hexyl 4-oxidanylidene-2-sulfanylidene-1H-pyrimidine-5-carboxylate

Systemtic Name: 6-[(4-ethenylphenyl)methoxy]hexyl 4-oxidanylidene-2-sulfanylidene-1H-pyrimidine-5-carboxylate Openeye Name: 6-[(4-vinylphenyl)methoxy]hexyl 4-oxo-2-thioxo-1H-pyrimidine-5-carboxylate CAS Name: 4-oxo-2-sulfanylidene-1H-pyrimidine-5-carboxylic acid 6-[(4-ethenylphenyl)methoxy]hexyl ester IUPAC Name: 6-[(4-ethenylphenyl)methoxy]hexyl 4-oxo-2-sulfanylidene-1H-pyrimidine-5-carboxylate Traditional Name: 4-keto-2-thioxo-1H-pyrimidine-5-carboxylic acid 6-(4-vinylbenzyl)oxyhexyl ester Formula: C20H24N2O4S MolecularWeight: 388.48056

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Descriptors Computed from Structure

Canonical SMILES:

C=CC1=CC=C(C=C1)COCCCCCCOC(=O)C2=CNC(=S)NC2=O

Isomeric SMILES

C=CC1=CC=C(C=C1)COCCCCCCOC(=O)C2=CNC(=S)NC2=O

InChI

InChI=1S/C20H24N2O4S/c1-2-15-7-9-16(10-8-15)14-25-11-5-3-4-6-12-26-19(24)17-13-21-20(27)22-18(17)23/h2,7-10,13H,1,3-6,11-12,14H2,(H2,21,22,23,27)