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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)CN2C(=O)CC(=O)NC2=S)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)CN2C(=O)CC(=O)NC2=S)OC

InChI

InChI=1S/C16H20N2O4S/c1-3-4-7-22-12-6-5-11(8-13(12)21-2)10-18-15(20)9-14(19)17-16(18)23/h5-6,8H,3-4,7,9-10H2,1-2H3,(H,17,19,23)