2-[(2-methoxy-5-methyl-phenyl)-(4-methylphenyl)sulfonyl-amino]-N-[3-(4-methylpiperazin-1-yl)propyl]ethanamide

Systemtic Name: 2-[(2-methoxy-5-methyl-phenyl)-(4-methylphenyl)sulfonyl-amino]-N-[3-(4-methylpiperazin-1-yl)propyl]ethanamide Openeye Name: 2-[2-methoxy-5-methyl-N-(p-tolylsulfonyl)anilino]-N-[3-(4-methylpiperazin-1-yl)propyl]acetamide CAS Name: 2-(2-methoxy-5-methyl-N-(4-methylphenyl)sulfonylanilino)-N-[3-(4-methyl-1-piperazinyl)propyl]acetamide IUPAC Name: 2-(2-methoxy-5-methyl-N-(4-methylphenyl)sulfonylanilino)-N-[3-(4-methylpiperazin-1-yl)propyl]acetamide Traditional Name: 2-(2-methoxy-5-methyl-N-tosyl-anilino)-N-[3-(4-methylpiperazino)propyl]acetamide Formula: C25H36N4O4S MolecularWeight: 488.64274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCCCN2CCN(CC2)C)C3=C(C=CC(=C3)C)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCCCN2CCN(CC2)C)C3=C(C=CC(=C3)C)OC

InChI

InChI=1S/C25H36N4O4S/c1-20-6-9-22(10-7-20)34(31,32)29(23-18-21(2)8-11-24(23)33-4)19-25(30)26-12-5-13-28-16-14-27(3)15-17-28/h6-11,18H,5,12-17,19H2,1-4H3,(H,26,30)