5-[[4-(4-methoxybutoxy)phenyl]methyl]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[[4-(4-methoxybutoxy)phenyl]methyl]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[[4-(4-methoxybutoxy)phenyl]methyl]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[[4-(4-methoxybutoxy)phenyl]methyl]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[[4-(4-methoxybutoxy)phenyl]methyl]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[4-(4-methoxybutoxy)benzyl]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C16H20N2O4S MolecularWeight: 336.406

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Descriptors Computed from Structure

Canonical SMILES:

COCCCCOC1=CC=C(C=C1)CC2C(=O)NC(=S)NC2=O

Isomeric SMILES

COCCCCOC1=CC=C(C=C1)CC2C(=O)NC(=S)NC2=O

InChI

InChI=1S/C16H20N2O4S/c1-21-8-2-3-9-22-12-6-4-11(5-7-12)10-13-14(19)17-16(23)18-15(13)20/h4-7,13H,2-3,8-10H2,1H3,(H2,17,18,19,20,23)