5-(4-methylpiperazin-1-yl)-2,4-bis(morpholin-4-ylsulfonyl)-N-phenethyl-aniline

Systemtic Name: 5-(4-methylpiperazin-1-yl)-2,4-bis(morpholin-4-ylsulfonyl)-N-phenethyl-aniline Openeye Name: 5-(4-methylpiperazin-1-yl)-2,4-bis(morpholinosulfonyl)-N-phenethyl-aniline CAS Name: 5-(4-methyl-1-piperazinyl)-2,4-bis(4-morpholinylsulfonyl)-N-phenethylaniline IUPAC Name: 5-(4-methylpiperazin-1-yl)-2,4-bis(morpholin-4-ylsulfonyl)-N-phenethylaniline Traditional Name: [5-(4-methylpiperazino)-2,4-bis(morpholinosulfonyl)phenyl]-phenethyl-amine Formula: C27H39N5O6S2 MolecularWeight: 593.75846

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC(=C(C=C2S(=O)(=O)N3CCOCC3)S(=O)(=O)N4CCOCC4)NCCC5=CC=CC=C5

Isomeric SMILES

CN1CCN(CC1)C2=CC(=C(C=C2S(=O)(=O)N3CCOCC3)S(=O)(=O)N4CCOCC4)NCCC5=CC=CC=C5

InChI

InChI=1S/C27H39N5O6S2/c1-29-9-11-30(12-10-29)25-21-24(28-8-7-23-5-3-2-4-6-23)26(39(33,34)31-13-17-37-18-14-31)22-27(25)40(35,36)32-15-19-38-20-16-32/h2-6,21-22,28H,7-20H2,1H3