2-[4-[2-(3-chloranylpyridin-2-yl)sulfanylethanoyl]piperazin-1-yl]-N-(4-methylphenyl)ethanamide

Systemtic Name: 2-[4-[2-(3-chloranylpyridin-2-yl)sulfanylethanoyl]piperazin-1-yl]-N-(4-methylphenyl)ethanamide Openeye Name: 2-[4-[2-[(3-chloro-2-pyridyl)sulfanyl]acetyl]piperazin-1-yl]-N-(p-tolyl)acetamide CAS Name: 2-[4-[2-[(3-chloro-2-pyridinyl)thio]-1-oxoethyl]-1-piperazinyl]-N-(4-methylphenyl)acetamide IUPAC Name: 2-[4-[2-(3-chloropyridin-2-yl)sulfanylacetyl]piperazin-1-yl]-N-(4-methylphenyl)acetamide Traditional Name: 2-[4-[2-[(3-chloro-2-pyridyl)thio]acetyl]piperazino]-N-(p-tolyl)acetamide Formula: C20H23ClN4O2S MolecularWeight: 418.94022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CN2CCN(CC2)C(=O)CSC3=C(C=CC=N3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CN2CCN(CC2)C(=O)CSC3=C(C=CC=N3)Cl

InChI

InChI=1S/C20H23ClN4O2S/c1-15-4-6-16(7-5-15)23-18(26)13-24-9-11-25(12-10-24)19(27)14-28-20-17(21)3-2-8-22-20/h2-8H,9-14H2,1H3,(H,23,26)