2-[(2-methylphenyl)-methylsulfonyl-amino]-N-[3-(4-phenylpiperazin-1-yl)propyl]ethanamide

Systemtic Name: 2-[(2-methylphenyl)-methylsulfonyl-amino]-N-[3-(4-phenylpiperazin-1-yl)propyl]ethanamide Openeye Name: 2-(2-methyl-N-methylsulfonyl-anilino)-N-[3-(4-phenylpiperazin-1-yl)propyl]acetamide CAS Name: 2-(2-methyl-N-methylsulfonylanilino)-N-[3-(4-phenyl-1-piperazinyl)propyl]acetamide IUPAC Name: 2-(2-methyl-N-methylsulfonylanilino)-N-[3-(4-phenylpiperazin-1-yl)propyl]acetamide Traditional Name: 2-(N-mesyl-2-methyl-anilino)-N-[3-(4-phenylpiperazino)propyl]acetamide Formula: C23H32N4O3S MolecularWeight: 444.59018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N(CC(=O)NCCCN2CCN(CC2)C3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

CC1=CC=CC=C1N(CC(=O)NCCCN2CCN(CC2)C3=CC=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C23H32N4O3S/c1-20-9-6-7-12-22(20)27(31(2,29)30)19-23(28)24-13-8-14-25-15-17-26(18-16-25)21-10-4-3-5-11-21/h3-7,9-12H,8,13-19H2,1-2H3,(H,24,28)