octan-3-yl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: octan-3-yl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: 1-ethylhexyl 6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid octan-3-yl ester IUPAC Name: octan-3-yl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 1-ethylhexyl ester Formula: C14H24N2O2S MolecularWeight: 284.41756

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)OC(=O)C1=C(NC(=S)NC1)C

Isomeric SMILES

CCCCCC(CC)OC(=O)C1=C(NC(=S)NC1)C

InChI

InChI=1S/C14H24N2O2S/c1-4-6-7-8-11(5-2)18-13(17)12-9-15-14(19)16-10(12)3/h11H,4-9H2,1-3H3,(H2,15,16,19)