5-chloranyl-N-(2,2-diphenylpropyl)-2-methylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-(2,2-diphenylpropyl)-2-methylsulfanyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-(2,2-diphenylpropyl)-2-methylsulfanyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-(2,2-diphenylpropyl)-2-(methylthio)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-(2,2-diphenylpropyl)-2-methylsulfanylpyrimidine-4-carboxamide Traditional Name: 5-chloro-N-(2,2-diphenylpropyl)-2-(methylthio)pyrimidine-4-carboxamide Formula: C21H20ClN3OS MolecularWeight: 397.921

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C1=NC(=NC=C1Cl)SC)(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(CNC(=O)C1=NC(=NC=C1Cl)SC)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H20ClN3OS/c1-21(15-9-5-3-6-10-15,16-11-7-4-8-12-16)14-24-19(26)18-17(22)13-23-20(25-18)27-2/h3-13H,14H2,1-2H3,(H,24,26)