2-[(4-ethoxyphenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]-N-[3-(4-methylpiperazin-1-yl)propyl]ethanamide

Systemtic Name: 2-[(4-ethoxyphenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]-N-[3-(4-methylpiperazin-1-yl)propyl]ethanamide Openeye Name: 2-(4-ethoxy-N-(4-methylsulfanylphenyl)sulfonyl-anilino)-N-[3-(4-methylpiperazin-1-yl)propyl]acetamide CAS Name: 2-(4-ethoxy-N-[4-(methylthio)phenyl]sulfonylanilino)-N-[3-(4-methyl-1-piperazinyl)propyl]acetamide IUPAC Name: 2-(4-ethoxy-N-(4-methylsulfanylphenyl)sulfonylanilino)-N-[3-(4-methylpiperazin-1-yl)propyl]acetamide Traditional Name: 2-(4-ethoxy-N-[4-(methylthio)phenyl]sulfonyl-anilino)-N-[3-(4-methylpiperazino)propyl]acetamide Formula: C25H36N4O4S2 MolecularWeight: 520.70774

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(CC(=O)NCCCN2CCN(CC2)C)S(=O)(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

CCOC1=CC=C(C=C1)N(CC(=O)NCCCN2CCN(CC2)C)S(=O)(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C25H36N4O4S2/c1-4-33-22-8-6-21(7-9-22)29(35(31,32)24-12-10-23(34-3)11-13-24)20-25(30)26-14-5-15-28-18-16-27(2)17-19-28/h6-13H,4-5,14-20H2,1-3H3,(H,26,30)