cyclohexyl-methyl-[[2-[[2-oxidanylidene-2-[(3-pyrrolidin-1-ylsulfonylphenyl)amino]ethyl]amino]phenyl]methyl]azanium

Systemtic Name: cyclohexyl-methyl-[[2-[[2-oxidanylidene-2-[(3-pyrrolidin-1-ylsulfonylphenyl)amino]ethyl]amino]phenyl]methyl]azanium Openeye Name: cyclohexyl-methyl-[[2-[[2-oxo-2-(3-pyrrolidin-1-ylsulfonylanilino)ethyl]amino]phenyl]methyl]ammonium CAS Name: cyclohexyl-methyl-[[2-[[2-oxo-2-[3-(1-pyrrolidinylsulfonyl)anilino]ethyl]amino]phenyl]methyl]ammonium IUPAC Name: cyclohexyl-methyl-[[2-[[2-oxo-2-(3-pyrrolidin-1-ylsulfonylanilino)ethyl]amino]phenyl]methyl]azanium Traditional Name: cyclohexyl-[2-[[2-keto-2-(3-pyrrolidinosulfonylanilino)ethyl]amino]benzyl]-methyl-ammonium Formula: C26H37N4O3S+ MolecularWeight: 485.66198

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1NCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3)C4CCCCC4

Isomeric SMILES

C[NH+](CC1=CC=CC=C1NCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3)C4CCCCC4

InChI

InChI=1S/C26H36N4O3S/c1-29(23-12-3-2-4-13-23)20-21-10-5-6-15-25(21)27-19-26(31)28-22-11-9-14-24(18-22)34(32,33)30-16-7-8-17-30/h5-6,9-11,14-15,18,23,27H,2-4,7-8,12-13,16-17,19-20H2,1H3,(H,28,31)/p+1