5-chloranyl-2-methylsulfanyl-N-[(1-phenylcyclopropyl)methyl]pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-2-methylsulfanyl-N-[(1-phenylcyclopropyl)methyl]pyrimidine-4-carboxamide Openeye Name: 5-chloro-2-methylsulfanyl-N-[(1-phenylcyclopropyl)methyl]pyrimidine-4-carboxamide CAS Name: 5-chloro-2-(methylthio)-N-[(1-phenylcyclopropyl)methyl]-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-2-methylsulfanyl-N-[(1-phenylcyclopropyl)methyl]pyrimidine-4-carboxamide Traditional Name: 5-chloro-2-(methylthio)-N-[(1-phenylcyclopropyl)methyl]pyrimidine-4-carboxamide Formula: C16H16ClN3OS MolecularWeight: 333.83574

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)C(=O)NCC2(CC2)C3=CC=CC=C3)Cl

Isomeric SMILES

CSC1=NC=C(C(=N1)C(=O)NCC2(CC2)C3=CC=CC=C3)Cl

InChI

InChI=1S/C16H16ClN3OS/c1-22-15-18-9-12(17)13(20-15)14(21)19-10-16(7-8-16)11-5-3-2-4-6-11/h2-6,9H,7-8,10H2,1H3,(H,19,21)