methyl 2-cyclopropyl-4-methyl-6-[2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl]sulfanyl-pyrimidine-5-carboxylate

Systemtic Name: methyl 2-cyclopropyl-4-methyl-6-[2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl]sulfanyl-pyrimidine-5-carboxylate Openeye Name: methyl 2-cyclopropyl-4-methyl-6-[2-oxo-2-[2-(2-thienyl)ethylamino]ethyl]sulfanyl-pyrimidine-5-carboxylate CAS Name: 2-cyclopropyl-4-methyl-6-[[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]thio]-5-pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 2-cyclopropyl-4-methyl-6-[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]sulfanylpyrimidine-5-carboxylate Traditional Name: 2-cyclopropyl-4-[[2-keto-2-[2-(2-thienyl)ethylamino]ethyl]thio]-6-methyl-pyrimidine-5-carboxylic acid methyl ester Formula: C18H21N3O3S2 MolecularWeight: 391.50764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2CC2)SCC(=O)NCCC3=CC=CS3)C(=O)OC

Isomeric SMILES

CC1=C(C(=NC(=N1)C2CC2)SCC(=O)NCCC3=CC=CS3)C(=O)OC

InChI

InChI=1S/C18H21N3O3S2/c1-11-15(18(23)24-2)17(21-16(20-11)12-5-6-12)26-10-14(22)19-8-7-13-4-3-9-25-13/h3-4,9,12H,5-8,10H2,1-2H3,(H,19,22)