ethyl 3-(3-ethoxypropyl)-4-methyl-6-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 3-(3-ethoxypropyl)-4-methyl-6-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-(3-ethoxypropyl)-4-methyl-6-phenyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-(3-ethoxypropyl)-4-methyl-6-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(3-ethoxypropyl)-4-methyl-6-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-(3-ethoxypropyl)-4-methyl-6-phenyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C19H26N2O3S MolecularWeight: 362.48634

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN1C(=C(C(NC1=S)C2=CC=CC=C2)C(=O)OCC)C

Isomeric SMILES

CCOCCCN1C(=C(C(NC1=S)C2=CC=CC=C2)C(=O)OCC)C

InChI

InChI=1S/C19H26N2O3S/c1-4-23-13-9-12-21-14(3)16(18(22)24-5-2)17(20-19(21)25)15-10-7-6-8-11-15/h6-8,10-11,17H,4-5,9,12-13H2,1-3H3,(H,20,25)