methyl 3-azanyl-6-chloranyl-5-[(3,4-dichlorophenyl)methylsulfanyl]pyrazine-2-carboxylate

Systemtic Name: methyl 3-azanyl-6-chloranyl-5-[(3,4-dichlorophenyl)methylsulfanyl]pyrazine-2-carboxylate Openeye Name: methyl 3-amino-6-chloro-5-[(3,4-dichlorophenyl)methylsulfanyl]pyrazine-2-carboxylate CAS Name: 3-amino-6-chloro-5-[(3,4-dichlorophenyl)methylthio]-2-pyrazinecarboxylic acid methyl ester IUPAC Name: methyl 3-amino-6-chloro-5-[(3,4-dichlorophenyl)methylsulfanyl]pyrazine-2-carboxylate Traditional Name: 3-amino-6-chloro-5-[(3,4-dichlorobenzyl)thio]pyrazinic acid methyl ester Formula: C13H10Cl3N3O2S MolecularWeight: 378.6614

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N=C(C(=N1)Cl)SCC2=CC(=C(C=C2)Cl)Cl)N

Isomeric SMILES

COC(=O)C1=C(N=C(C(=N1)Cl)SCC2=CC(=C(C=C2)Cl)Cl)N

InChI

InChI=1S/C13H10Cl3N3O2S/c1-21-13(20)9-11(17)19-12(10(16)18-9)22-5-6-2-3-7(14)8(15)4-6/h2-4H,5H2,1H3,(H2,17,19)