N-[(4-dimethylaminophenyl)methyl]-2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-[(4-dimethylaminophenyl)methyl]-2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: N-[(4-dimethylaminophenyl)methyl]-2-[4-(p-tolylsulfonyl)piperazin-1-yl]acetamide CAS Name: N-[(4-dimethylaminophenyl)methyl]-2-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: N-[(4-dimethylaminophenyl)methyl]-2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]acetamide Traditional Name: N-[4-(dimethylamino)benzyl]-2-(4-tosylpiperazino)acetamide Formula: C22H30N4O3S MolecularWeight: 430.5636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NCC3=CC=C(C=C3)N(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NCC3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C22H30N4O3S/c1-18-4-10-21(11-5-18)30(28,29)26-14-12-25(13-15-26)17-22(27)23-16-19-6-8-20(9-7-19)24(2)3/h4-11H,12-17H2,1-3H3,(H,23,27)