1-[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylethanoyl]piperidine-3-carboxamide

Systemtic Name: 1-[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylethanoyl]piperidine-3-carboxamide Openeye Name: 1-[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylacetyl]piperidine-3-carboxamide CAS Name: 1-[2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]-1-oxoethyl]-3-piperidinecarboxamide IUPAC Name: 1-[2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylacetyl]piperidine-3-carboxamide Traditional Name: 1-[2-[(4-methyl-6-phenyl-pyrimidin-2-yl)thio]acetyl]nipecotamide Formula: C19H22N4O2S MolecularWeight: 370.46858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)N3CCCC(C3)C(=O)N

Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)N3CCCC(C3)C(=O)N

InChI

InChI=1S/C19H22N4O2S/c1-13-10-16(14-6-3-2-4-7-14)22-19(21-13)26-12-17(24)23-9-5-8-15(11-23)18(20)25/h2-4,6-7,10,15H,5,8-9,11-12H2,1H3,(H2,20,25)