methyl 2-cyclopropyl-4-methyl-6-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-pyrimidine-5-carboxylate

Systemtic Name: methyl 2-cyclopropyl-4-methyl-6-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-pyrimidine-5-carboxylate Openeye Name: methyl 4-(2-anilino-2-oxo-ethyl)sulfanyl-2-cyclopropyl-6-methyl-pyrimidine-5-carboxylate CAS Name: 4-[(2-anilino-2-oxoethyl)thio]-2-cyclopropyl-6-methyl-5-pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 4-(2-anilino-2-oxoethyl)sulfanyl-2-cyclopropyl-6-methylpyrimidine-5-carboxylate Traditional Name: 4-[(2-anilino-2-keto-ethyl)thio]-2-cyclopropyl-6-methyl-pyrimidine-5-carboxylic acid methyl ester Formula: C18H19N3O3S MolecularWeight: 357.42676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2CC2)SCC(=O)NC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1=C(C(=NC(=N1)C2CC2)SCC(=O)NC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C18H19N3O3S/c1-11-15(18(23)24-2)17(21-16(19-11)12-8-9-12)25-10-14(22)20-13-6-4-3-5-7-13/h3-7,12H,8-10H2,1-2H3,(H,20,22)