5-(4-methylpiperazin-1-yl)-N-(3-phenylpropyl)-2,4-bis(pyrrolidin-1-ylsulfonyl)aniline

Systemtic Name: 5-(4-methylpiperazin-1-yl)-N-(3-phenylpropyl)-2,4-bis(pyrrolidin-1-ylsulfonyl)aniline Openeye Name: 5-(4-methylpiperazin-1-yl)-N-(3-phenylpropyl)-2,4-bis(pyrrolidin-1-ylsulfonyl)aniline CAS Name: 5-(4-methyl-1-piperazinyl)-N-(3-phenylpropyl)-2,4-bis(1-pyrrolidinylsulfonyl)aniline IUPAC Name: 5-(4-methylpiperazin-1-yl)-N-(3-phenylpropyl)-2,4-bis(pyrrolidin-1-ylsulfonyl)aniline Traditional Name: [5-(4-methylpiperazino)-2,4-bis(pyrrolidinosulfonyl)phenyl]-(3-phenylpropyl)amine Formula: C28H41N5O4S2 MolecularWeight: 575.78624

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC(=C(C=C2S(=O)(=O)N3CCCC3)S(=O)(=O)N4CCCC4)NCCCC5=CC=CC=C5

Isomeric SMILES

CN1CCN(CC1)C2=CC(=C(C=C2S(=O)(=O)N3CCCC3)S(=O)(=O)N4CCCC4)NCCCC5=CC=CC=C5

InChI

InChI=1S/C28H41N5O4S2/c1-30-18-20-31(21-19-30)26-22-25(29-13-9-12-24-10-3-2-4-11-24)27(38(34,35)32-14-5-6-15-32)23-28(26)39(36,37)33-16-7-8-17-33/h2-4,10-11,22-23,29H,5-9,12-21H2,1H3