N-methyl-4-[2-[4-(2-oxidanylidene-1,4-diazepan-1-yl)butyl-propyl-amino]propyl]benzenesulfonamide

Systemtic Name: N-methyl-4-[2-[4-(2-oxidanylidene-1,4-diazepan-1-yl)butyl-propyl-amino]propyl]benzenesulfonamide Openeye Name: N-methyl-4-[2-[4-(2-oxo-1,4-diazepan-1-yl)butyl-propyl-amino]propyl]benzenesulfonamide CAS Name: N-methyl-4-[2-[4-(2-oxo-1,4-diazepan-1-yl)butyl-propylamino]propyl]benzenesulfonamide IUPAC Name: N-methyl-4-[2-[4-(2-oxo-1,4-diazepan-1-yl)butyl-propylamino]propyl]benzenesulfonamide Traditional Name: 4-[2-[4-(2-keto-1,4-diazepan-1-yl)butyl-propyl-amino]propyl]-N-methyl-benzenesulfonamide Formula: C22H38N4O3S MolecularWeight: 438.62712

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCCCN1CCCNCC1=O)C(C)CC2=CC=C(C=C2)S(=O)(=O)NC

Isomeric SMILES

CCCN(CCCCN1CCCNCC1=O)C(C)CC2=CC=C(C=C2)S(=O)(=O)NC

InChI

InChI=1S/C22H38N4O3S/c1-4-13-25(14-5-6-15-26-16-7-12-24-18-22(26)27)19(2)17-20-8-10-21(11-9-20)30(28,29)23-3/h8-11,19,23-24H,4-7,12-18H2,1-3H3