4-[2-(4-methylpyrimidin-2-yl)sulfanylethanoylamino]-N-[2-(2-naphthalen-1-ylethanoylamino)ethyl]piperidine-4-carboxamide

Systemtic Name: 4-[2-(4-methylpyrimidin-2-yl)sulfanylethanoylamino]-N-[2-(2-naphthalen-1-ylethanoylamino)ethyl]piperidine-4-carboxamide Openeye Name: 4-[[2-(4-methylpyrimidin-2-yl)sulfanylacetyl]amino]-N-[2-[[2-(1-naphthyl)acetyl]amino]ethyl]piperidine-4-carboxamide CAS Name: 4-[[2-[(4-methyl-2-pyrimidinyl)thio]-1-oxoethyl]amino]-N-[2-[[2-(1-naphthalenyl)-1-oxoethyl]amino]ethyl]-4-piperidinecarboxamide IUPAC Name: 4-[[2-(4-methylpyrimidin-2-yl)sulfanylacetyl]amino]-N-[2-[(2-naphthalen-1-ylacetyl)amino]ethyl]piperidine-4-carboxamide Traditional Name: 4-[[2-[(4-methylpyrimidin-2-yl)thio]acetyl]amino]-N-[2-[[2-(1-naphthyl)acetyl]amino]ethyl]isonipecotamide Formula: C27H32N6O3S MolecularWeight: 520.64638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)SCC(=O)NC2(CCNCC2)C(=O)NCCNC(=O)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC1=NC(=NC=C1)SCC(=O)NC2(CCNCC2)C(=O)NCCNC(=O)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C27H32N6O3S/c1-19-9-12-31-26(32-19)37-18-24(35)33-27(10-13-28-14-11-27)25(36)30-16-15-29-23(34)17-21-7-4-6-20-5-2-3-8-22(20)21/h2-9,12,28H,10-11,13-18H2,1H3,(H,29,34)(H,30,36)(H,33,35)