(3,4-diethoxyphenyl)-[2-[4-(4-methylpiperazin-1-yl)sulfonylpiperazin-1-yl]carbonylphenyl]methanone

Systemtic Name: (3,4-diethoxyphenyl)-[2-[4-(4-methylpiperazin-1-yl)sulfonylpiperazin-1-yl]carbonylphenyl]methanone Openeye Name: (3,4-diethoxyphenyl)-[2-[4-(4-methylpiperazin-1-yl)sulfonylpiperazine-1-carbonyl]phenyl]methanone CAS Name: (3,4-diethoxyphenyl)-[2-[[4-[(4-methyl-1-piperazinyl)sulfonyl]-1-piperazinyl]-oxomethyl]phenyl]methanone IUPAC Name: (3,4-diethoxyphenyl)-[2-[4-(4-methylpiperazin-1-yl)sulfonylpiperazine-1-carbonyl]phenyl]methanone Traditional Name: (3,4-diethoxyphenyl)-[2-[4-(4-methylpiperazino)sulfonylpiperazine-1-carbonyl]phenyl]methanone Formula: C27H36N4O6S MolecularWeight: 544.66294

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)N3CCN(CC3)S(=O)(=O)N4CCN(CC4)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)N3CCN(CC3)S(=O)(=O)N4CCN(CC4)C)OCC

InChI

InChI=1S/C27H36N4O6S/c1-4-36-24-11-10-21(20-25(24)37-5-2)26(32)22-8-6-7-9-23(22)27(33)29-14-18-31(19-15-29)38(34,35)30-16-12-28(3)13-17-30/h6-11,20H,4-5,12-19H2,1-3H3