N-[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]-2-phenethylsulfanyl-ethanamide

Systemtic Name: N-[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]-2-phenethylsulfanyl-ethanamide Openeye Name: N-[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]-2-phenethylsulfanyl-acetamide CAS Name: N-[4-(4-ethyl-1-piperazinyl)-3-methylphenyl]-2-(phenethylthio)acetamide IUPAC Name: N-[4-(4-ethylpiperazin-1-yl)-3-methylphenyl]-2-phenethylsulfanylacetamide Traditional Name: N-[4-(4-ethylpiperazino)-3-methyl-phenyl]-2-(phenethylthio)acetamide Formula: C23H31N3OS MolecularWeight: 397.57674

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)NC(=O)CSCCC3=CC=CC=C3)C

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)NC(=O)CSCCC3=CC=CC=C3)C

InChI

InChI=1S/C23H31N3OS/c1-3-25-12-14-26(15-13-25)22-10-9-21(17-19(22)2)24-23(27)18-28-16-11-20-7-5-4-6-8-20/h4-10,17H,3,11-16,18H2,1-2H3,(H,24,27)