2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-[2-(4-phenylpiperazin-1-yl)ethyl]benzamide

Systemtic Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-[2-(4-phenylpiperazin-1-yl)ethyl]benzamide Openeye Name: 2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-N-[2-(4-phenylpiperazin-1-yl)ethyl]benzamide CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-N-[2-(4-phenyl-1-piperazinyl)ethyl]benzamide IUPAC Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-[2-(4-phenylpiperazin-1-yl)ethyl]benzamide Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methylthio]-N-[2-(4-phenylpiperazino)ethyl]benzamide Formula: C25H30N4O2S MolecularWeight: 450.5963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSC2=CC=CC=C2C(=O)NCCN3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=NO1)C)CSC2=CC=CC=C2C(=O)NCCN3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C25H30N4O2S/c1-19-23(20(2)31-27-19)18-32-24-11-7-6-10-22(24)25(30)26-12-13-28-14-16-29(17-15-28)21-8-4-3-5-9-21/h3-11H,12-18H2,1-2H3,(H,26,30)