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

Systemtic Name: 5-chloranyl-N-[2-methyl-5-(2-methylpropanoylamino)phenyl]-2-methylsulfanyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-[2-methyl-5-(2-methylpropanoylamino)phenyl]-2-methylsulfanyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[2-methyl-5-[(2-methyl-1-oxopropyl)amino]phenyl]-2-(methylthio)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-[2-methyl-5-(2-methylpropanoylamino)phenyl]-2-methylsulfanylpyrimidine-4-carboxamide Traditional Name: 5-chloro-N-[5-(isobutyrylamino)-2-methyl-phenyl]-2-(methylthio)pyrimidine-4-carboxamide Formula: C17H19ClN4O2S MolecularWeight: 378.87636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)C)NC(=O)C2=NC(=NC=C2Cl)SC

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(C)C)NC(=O)C2=NC(=NC=C2Cl)SC

InChI

InChI=1S/C17H19ClN4O2S/c1-9(2)15(23)20-11-6-5-10(3)13(7-11)21-16(24)14-12(18)8-19-17(22-14)25-4/h5-9H,1-4H3,(H,20,23)(H,21,24)