5-chloranyl-N-[(4-methoxyphenyl)-phenyl-methyl]-2-methylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-[(4-methoxyphenyl)-phenyl-methyl]-2-methylsulfanyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-[(4-methoxyphenyl)-phenyl-methyl]-2-methylsulfanyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[(4-methoxyphenyl)-phenylmethyl]-2-(methylthio)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-[(4-methoxyphenyl)-phenylmethyl]-2-methylsulfanylpyrimidine-4-carboxamide Traditional Name: 5-chloro-N-[(4-methoxyphenyl)-phenyl-methyl]-2-(methylthio)pyrimidine-4-carboxamide Formula: C20H18ClN3O2S MolecularWeight: 399.89382

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=O)C3=NC(=NC=C3Cl)SC

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=O)C3=NC(=NC=C3Cl)SC

InChI

InChI=1S/C20H18ClN3O2S/c1-26-15-10-8-14(9-11-15)17(13-6-4-3-5-7-13)23-19(25)18-16(21)12-22-20(24-18)27-2/h3-12,17H,1-2H3,(H,23,25)