N-(5-methyl-1,2-oxazol-3-yl)-2-[4-(2-phenylsulfanylpropanoyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(5-methyl-1,2-oxazol-3-yl)-2-[4-(2-phenylsulfanylpropanoyl)piperazin-1-yl]ethanamide Openeye Name: N-(5-methylisoxazol-3-yl)-2-[4-(2-phenylsulfanylpropanoyl)piperazin-1-yl]acetamide CAS Name: N-(5-methyl-3-isoxazolyl)-2-[4-[1-oxo-2-(phenylthio)propyl]-1-piperazinyl]acetamide IUPAC Name: N-(5-methyl-1,2-oxazol-3-yl)-2-[4-(2-phenylsulfanylpropanoyl)piperazin-1-yl]acetamide Traditional Name: N-(5-methylisoxazol-3-yl)-2-[4-[2-(phenylthio)propanoyl]piperazino]acetamide Formula: C19H24N4O3S MolecularWeight: 388.48386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)CN2CCN(CC2)C(=O)C(C)SC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=NO1)NC(=O)CN2CCN(CC2)C(=O)C(C)SC3=CC=CC=C3

InChI

InChI=1S/C19H24N4O3S/c1-14-12-17(21-26-14)20-18(24)13-22-8-10-23(11-9-22)19(25)15(2)27-16-6-4-3-5-7-16/h3-7,12,15H,8-11,13H2,1-2H3,(H,20,21,24)