5-chloranyl-N-[(1-methylimidazol-2-yl)-phenyl-methyl]-2-methylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-[(1-methylimidazol-2-yl)-phenyl-methyl]-2-methylsulfanyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-[(1-methylimidazol-2-yl)-phenyl-methyl]-2-methylsulfanyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[(1-methyl-2-imidazolyl)-phenylmethyl]-2-(methylthio)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-[(1-methylimidazol-2-yl)-phenylmethyl]-2-methylsulfanylpyrimidine-4-carboxamide Traditional Name: 5-chloro-N-[(1-methylimidazol-2-yl)-phenyl-methyl]-2-(methylthio)pyrimidine-4-carboxamide Formula: C17H16ClN5OS MolecularWeight: 373.85984

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(C2=CC=CC=C2)NC(=O)C3=NC(=NC=C3Cl)SC

Isomeric SMILES

CN1C=CN=C1C(C2=CC=CC=C2)NC(=O)C3=NC(=NC=C3Cl)SC

InChI

InChI=1S/C17H16ClN5OS/c1-23-9-8-19-15(23)13(11-6-4-3-5-7-11)21-16(24)14-12(18)10-20-17(22-14)25-2/h3-10,13H,1-2H3,(H,21,24)