2-(2,5-dimethylphenyl)sulfanyl-N-[4-(4-ethylpiperazin-1-yl)phenyl]ethanamide

Systemtic Name: 2-(2,5-dimethylphenyl)sulfanyl-N-[4-(4-ethylpiperazin-1-yl)phenyl]ethanamide Openeye Name: 2-(2,5-dimethylphenyl)sulfanyl-N-[4-(4-ethylpiperazin-1-yl)phenyl]acetamide CAS Name: 2-[(2,5-dimethylphenyl)thio]-N-[4-(4-ethyl-1-piperazinyl)phenyl]acetamide IUPAC Name: 2-(2,5-dimethylphenyl)sulfanyl-N-[4-(4-ethylpiperazin-1-yl)phenyl]acetamide Traditional Name: 2-[(2,5-dimethylphenyl)thio]-N-[4-(4-ethylpiperazino)phenyl]acetamide Formula: C22H29N3OS MolecularWeight: 383.55016

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC=C(C=C2)NC(=O)CSC3=C(C=CC(=C3)C)C

Isomeric SMILES

CCN1CCN(CC1)C2=CC=C(C=C2)NC(=O)CSC3=C(C=CC(=C3)C)C

InChI

InChI=1S/C22H29N3OS/c1-4-24-11-13-25(14-12-24)20-9-7-19(8-10-20)23-22(26)16-27-21-15-17(2)5-6-18(21)3/h5-10,15H,4,11-14,16H2,1-3H3,(H,23,26)