ethyl 4-azanyl-2-[(5-thiophen-2-yl-1,2,4-oxadiazol-3-yl)methylsulfanyl]pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[(5-thiophen-2-yl-1,2,4-oxadiazol-3-yl)methylsulfanyl]pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[[5-(2-thienyl)-1,2,4-oxadiazol-3-yl]methylsulfanyl]pyrimidine-5-carboxylate CAS Name: 4-amino-2-[(5-thiophen-2-yl-1,2,4-oxadiazol-3-yl)methylthio]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[(5-thiophen-2-yl-1,2,4-oxadiazol-3-yl)methylsulfanyl]pyrimidine-5-carboxylate Traditional Name: 4-amino-2-[[5-(2-thienyl)-1,2,4-oxadiazol-3-yl]methylthio]pyrimidine-5-carboxylic acid ethyl ester Formula: C14H13N5O3S2 MolecularWeight: 363.41472

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1N)SCC2=NOC(=N2)C3=CC=CS3

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1N)SCC2=NOC(=N2)C3=CC=CS3

InChI

InChI=1S/C14H13N5O3S2/c1-2-21-13(20)8-6-16-14(18-11(8)15)24-7-10-17-12(22-19-10)9-4-3-5-23-9/h3-6H,2,7H2,1H3,(H2,15,16,18)