N-[(2S)-butan-2-yl]-5-chloranyl-2-ethylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: N-[(2S)-butan-2-yl]-5-chloranyl-2-ethylsulfanyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-2-ethylsulfanyl-N-[(1S)-1-methylpropyl]pyrimidine-4-carboxamide CAS Name: N-[(2S)-butan-2-yl]-5-chloro-2-(ethylthio)-4-pyrimidinecarboxamide IUPAC Name: N-[(2S)-butan-2-yl]-5-chloro-2-ethylsulfanylpyrimidine-4-carboxamide Traditional Name: 5-chloro-2-(ethylthio)-N-[(1S)-1-methylpropyl]pyrimidine-4-carboxamide Formula: C11H16ClN3OS MolecularWeight: 273.78224

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=NC(=NC=C1Cl)SCC

Isomeric SMILES

CC[C@H](C)NC(=O)C1=NC(=NC=C1Cl)SCC

InChI

InChI=1S/C11H16ClN3OS/c1-4-7(3)14-10(16)9-8(12)6-13-11(15-9)17-5-2/h6-7H,4-5H2,1-3H3,(H,14,16)/t7-/m0/s1