5-chloranyl-N-[(3,4-dimethoxyphenyl)methyl]-2-methylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-[(3,4-dimethoxyphenyl)methyl]-2-methylsulfanyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-[(3,4-dimethoxyphenyl)methyl]-2-methylsulfanyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[(3,4-dimethoxyphenyl)methyl]-2-(methylthio)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-[(3,4-dimethoxyphenyl)methyl]-2-methylsulfanylpyrimidine-4-carboxamide Traditional Name: 5-chloro-2-(methylthio)-N-veratryl-pyrimidine-4-carboxamide Formula: C15H16ClN3O3S MolecularWeight: 353.82384

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C2=NC(=NC=C2Cl)SC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C2=NC(=NC=C2Cl)SC)OC

InChI

InChI=1S/C15H16ClN3O3S/c1-21-11-5-4-9(6-12(11)22-2)7-17-14(20)13-10(16)8-18-15(19-13)23-3/h4-6,8H,7H2,1-3H3,(H,17,20)