4-[4-[7-(4-azanylbutylamino)heptylamino]butyl-methyl-amino]benzenethiol

Systemtic Name: 4-[4-[7-(4-azanylbutylamino)heptylamino]butyl-methyl-amino]benzenethiol Openeye Name: 4-[4-[7-(4-aminobutylamino)heptylamino]butyl-methyl-amino]benzenethiol CAS Name: 4-[4-[7-(4-aminobutylamino)heptylamino]butyl-methylamino]benzenethiol IUPAC Name: 4-[4-[7-(4-aminobutylamino)heptylamino]butyl-methylamino]benzenethiol Traditional Name: 4-[4-[7-(4-aminobutylamino)heptylamino]butyl-methyl-amino]benzenethiol Formula: C22H42N4S MolecularWeight: 394.66068

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCCNCCCCCCCNCCCCN)C1=CC=C(C=C1)S

Isomeric SMILES

CN(CCCCNCCCCCCCNCCCCN)C1=CC=C(C=C1)S

InChI

InChI=1S/C22H42N4S/c1-26(21-11-13-22(27)14-12-21)20-10-9-19-25-17-7-4-2-3-6-16-24-18-8-5-15-23/h11-14,24-25,27H,2-10,15-20,23H2,1H3