1-[2-[4-chloranyl-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl]sulfanylethanoyl]piperidine-4-carboxamide

Systemtic Name: 1-[2-[4-chloranyl-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl]sulfanylethanoyl]piperidine-4-carboxamide Openeye Name: 1-[2-[4-chloro-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl]sulfanylacetyl]piperidine-4-carboxamide CAS Name: 1-[2-[[4-chloro-6-[cyclohexyl(methyl)amino]-2-pyrimidinyl]thio]-1-oxoethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-[4-chloro-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl]sulfanylacetyl]piperidine-4-carboxamide Traditional Name: 1-[2-[[4-chloro-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl]thio]acetyl]isonipecotamide Formula: C19H28ClN5O2S MolecularWeight: 425.97592

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C2=CC(=NC(=N2)SCC(=O)N3CCC(CC3)C(=O)N)Cl

Isomeric SMILES

CN(C1CCCCC1)C2=CC(=NC(=N2)SCC(=O)N3CCC(CC3)C(=O)N)Cl

InChI

InChI=1S/C19H28ClN5O2S/c1-24(14-5-3-2-4-6-14)16-11-15(20)22-19(23-16)28-12-17(26)25-9-7-13(8-10-25)18(21)27/h11,13-14H,2-10,12H2,1H3,(H2,21,27)