2-(4-tert-butylphenyl)sulfanyl-N-[4-(4-propanoylpiperazin-1-yl)phenyl]ethanamide

Systemtic Name: 2-(4-tert-butylphenyl)sulfanyl-N-[4-(4-propanoylpiperazin-1-yl)phenyl]ethanamide Openeye Name: 2-(4-tert-butylphenyl)sulfanyl-N-[4-(4-propanoylpiperazin-1-yl)phenyl]acetamide CAS Name: 2-[(4-tert-butylphenyl)thio]-N-[4-[4-(1-oxopropyl)-1-piperazinyl]phenyl]acetamide IUPAC Name: 2-(4-tert-butylphenyl)sulfanyl-N-[4-(4-propanoylpiperazin-1-yl)phenyl]acetamide Traditional Name: 2-[(4-tert-butylphenyl)thio]-N-[4-(4-propionylpiperazino)phenyl]acetamide Formula: C25H33N3O2S MolecularWeight: 439.61342

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)CSC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)CSC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C25H33N3O2S/c1-5-24(30)28-16-14-27(15-17-28)21-10-8-20(9-11-21)26-23(29)18-31-22-12-6-19(7-13-22)25(2,3)4/h6-13H,5,14-18H2,1-4H3,(H,26,29)