pent-4-ynyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: pent-4-ynyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: pent-4-ynyl 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 pent-4-ynyl ester IUPAC Name: pent-4-ynyl 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 pent-4-ynyl ester Formula: C11H14N2O2S MolecularWeight: 238.30606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CNC(=S)N1)C(=O)OCCCC#C

Isomeric SMILES

CC1=C(CNC(=S)N1)C(=O)OCCCC#C

InChI

InChI=1S/C11H14N2O2S/c1-3-4-5-6-15-10(14)9-7-12-11(16)13-8(9)2/h1H,4-7H2,2H3,(H2,12,13,16)