2-[4-(2-hydroxyethyl)piperazin-1-yl]-N-[3-methylsulfanyl-2,6-di(propan-2-yl)phenyl]ethanamide

Systemtic Name: 2-[4-(2-hydroxyethyl)piperazin-1-yl]-N-[3-methylsulfanyl-2,6-di(propan-2-yl)phenyl]ethanamide Openeye Name: N-(2,6-diisopropyl-3-methylsulfanyl-phenyl)-2-[4-(2-hydroxyethyl)piperazin-1-yl]acetamide CAS Name: 2-[4-(2-hydroxyethyl)-1-piperazinyl]-N-[3-(methylthio)-2,6-di(propan-2-yl)phenyl]acetamide IUPAC Name: 2-[4-(2-hydroxyethyl)piperazin-1-yl]-N-[3-methylsulfanyl-2,6-di(propan-2-yl)phenyl]acetamide Traditional Name: N-[2,6-diisopropyl-3-(methylthio)phenyl]-2-[4-(2-hydroxyethyl)piperazino]acetamide Formula: C21H35N3O2S MolecularWeight: 393.5865

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=C(C=C1)SC)C(C)C)NC(=O)CN2CCN(CC2)CCO

Isomeric SMILES

CC(C)C1=C(C(=C(C=C1)SC)C(C)C)NC(=O)CN2CCN(CC2)CCO

InChI

InChI=1S/C21H35N3O2S/c1-15(2)17-6-7-18(27-5)20(16(3)4)21(17)22-19(26)14-24-10-8-23(9-11-24)12-13-25/h6-7,15-16,25H,8-14H2,1-5H3,(H,22,26)