N-(2,4-dimethoxyphenyl)-2-[4-[(4-methylsulfanylphenyl)methyl]piperazin-1-yl]ethanamide

Systemtic Name: N-(2,4-dimethoxyphenyl)-2-[4-[(4-methylsulfanylphenyl)methyl]piperazin-1-yl]ethanamide Openeye Name: N-(2,4-dimethoxyphenyl)-2-[4-[(4-methylsulfanylphenyl)methyl]piperazin-1-yl]acetamide CAS Name: N-(2,4-dimethoxyphenyl)-2-[4-[[4-(methylthio)phenyl]methyl]-1-piperazinyl]acetamide IUPAC Name: N-(2,4-dimethoxyphenyl)-2-[4-[(4-methylsulfanylphenyl)methyl]piperazin-1-yl]acetamide Traditional Name: N-(2,4-dimethoxyphenyl)-2-[4-[4-(methylthio)benzyl]piperazino]acetamide Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)CN2CCN(CC2)CC3=CC=C(C=C3)SC)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)CN2CCN(CC2)CC3=CC=C(C=C3)SC)OC

InChI

InChI=1S/C22H29N3O3S/c1-27-18-6-9-20(21(14-18)28-2)23-22(26)16-25-12-10-24(11-13-25)15-17-4-7-19(29-3)8-5-17/h4-9,14H,10-13,15-16H2,1-3H3,(H,23,26)