N-[4-(4-ethanoylpiperazin-1-yl)carbonylpiperidin-4-yl]-2-(4-methylsulfanylphenyl)ethanamide

Systemtic Name: N-[4-(4-ethanoylpiperazin-1-yl)carbonylpiperidin-4-yl]-2-(4-methylsulfanylphenyl)ethanamide Openeye Name: N-[4-(4-acetylpiperazine-1-carbonyl)-4-piperidyl]-2-(4-methylsulfanylphenyl)acetamide CAS Name: N-[4-[(4-acetyl-1-piperazinyl)-oxomethyl]-4-piperidinyl]-2-[4-(methylthio)phenyl]acetamide IUPAC Name: N-[4-(4-acetylpiperazine-1-carbonyl)piperidin-4-yl]-2-(4-methylsulfanylphenyl)acetamide Traditional Name: N-[4-(4-acetylpiperazine-1-carbonyl)-4-piperidyl]-2-[4-(methylthio)phenyl]acetamide Formula: C21H30N4O3S MolecularWeight: 418.5529

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)C2(CCNCC2)NC(=O)CC3=CC=C(C=C3)SC

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)C2(CCNCC2)NC(=O)CC3=CC=C(C=C3)SC

InChI

InChI=1S/C21H30N4O3S/c1-16(26)24-11-13-25(14-12-24)20(28)21(7-9-22-10-8-21)23-19(27)15-17-3-5-18(29-2)6-4-17/h3-6,22H,7-15H2,1-2H3,(H,23,27)