4-(cyclopropylamino)-3-(3-ethoxy-3-oxidanylidene-propyl)-2-ethylsulfanyl-4H-pyrimidine-5-carboxylic acid

Systemtic Name: 4-(cyclopropylamino)-3-(3-ethoxy-3-oxidanylidene-propyl)-2-ethylsulfanyl-4H-pyrimidine-5-carboxylic acid Openeye Name: 4-(cyclopropylamino)-3-(3-ethoxy-3-oxo-propyl)-2-ethylsulfanyl-4H-pyrimidine-5-carboxylic acid CAS Name: 4-(cyclopropylamino)-3-(3-ethoxy-3-oxopropyl)-2-(ethylthio)-4H-pyrimidine-5-carboxylic acid IUPAC Name: 4-(cyclopropylamino)-3-(3-ethoxy-3-oxopropyl)-2-ethylsulfanyl-4H-pyrimidine-5-carboxylic acid Traditional Name: 4-(cyclopropylamino)-3-(3-ethoxy-3-keto-propyl)-2-(ethylthio)-4H-pyrimidine-5-carboxylic acid Formula: C15H23N3O4S MolecularWeight: 341.42582

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN1C(C(=CN=C1SCC)C(=O)O)NC2CC2

Isomeric SMILES

CCOC(=O)CCN1C(C(=CN=C1SCC)C(=O)O)NC2CC2

InChI

InChI=1S/C15H23N3O4S/c1-3-22-12(19)7-8-18-13(17-10-5-6-10)11(14(20)21)9-16-15(18)23-4-2/h9-10,13,17H,3-8H2,1-2H3,(H,20,21)