ethyl 4-azanyl-2-[[(1R)-2,2-bis(chloranyl)cyclopropyl]methylsulfanyl]pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[[(1R)-2,2-bis(chloranyl)cyclopropyl]methylsulfanyl]pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[[(1R)-2,2-dichlorocyclopropyl]methylsulfanyl]pyrimidine-5-carboxylate CAS Name: 4-amino-2-[[(1R)-2,2-dichlorocyclopropyl]methylthio]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[[(1R)-2,2-dichlorocyclopropyl]methylsulfanyl]pyrimidine-5-carboxylate Traditional Name: 4-amino-2-[[(1R)-2,2-dichlorocyclopropyl]methylthio]pyrimidine-5-carboxylic acid ethyl ester Formula: C11H13Cl2N3O2S MolecularWeight: 322.21082

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1N)SCC2CC2(Cl)Cl

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1N)SC[C@H]2CC2(Cl)Cl

InChI

InChI=1S/C11H13Cl2N3O2S/c1-2-18-9(17)7-4-15-10(16-8(7)14)19-5-6-3-11(6,12)13/h4,6H,2-3,5H2,1H3,(H2,14,15,16)/t6-/m1/s1