N-cyclopropyl-2-[4-[2-(3,4-dimethylphenyl)sulfanylpyridin-3-yl]carbonylpiperazin-1-yl]ethanamide

Systemtic Name: N-cyclopropyl-2-[4-[2-(3,4-dimethylphenyl)sulfanylpyridin-3-yl]carbonylpiperazin-1-yl]ethanamide Openeye Name: N-cyclopropyl-2-[4-[2-(3,4-dimethylphenyl)sulfanylpyridine-3-carbonyl]piperazin-1-yl]acetamide CAS Name: N-cyclopropyl-2-[4-[[2-[(3,4-dimethylphenyl)thio]-3-pyridinyl]-oxomethyl]-1-piperazinyl]acetamide IUPAC Name: N-cyclopropyl-2-[4-[2-(3,4-dimethylphenyl)sulfanylpyridine-3-carbonyl]piperazin-1-yl]acetamide Traditional Name: N-cyclopropyl-2-[4-[2-[(3,4-dimethylphenyl)thio]nicotinoyl]piperazino]acetamide Formula: C23H28N4O2S MolecularWeight: 424.55902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SC2=C(C=CC=N2)C(=O)N3CCN(CC3)CC(=O)NC4CC4)C

Isomeric SMILES

CC1=C(C=C(C=C1)SC2=C(C=CC=N2)C(=O)N3CCN(CC3)CC(=O)NC4CC4)C

InChI

InChI=1S/C23H28N4O2S/c1-16-5-8-19(14-17(16)2)30-22-20(4-3-9-24-22)23(29)27-12-10-26(11-13-27)15-21(28)25-18-6-7-18/h3-5,8-9,14,18H,6-7,10-13,15H2,1-2H3,(H,25,28)