4-[3-(3-azanylpropylamino)propyl-(4-sulfanylphenyl)amino]benzenethiol

Systemtic Name: 4-[3-(3-azanylpropylamino)propyl-(4-sulfanylphenyl)amino]benzenethiol Openeye Name: 4-[N-[3-(3-aminopropylamino)propyl]-4-sulfanyl-anilino]benzenethiol CAS Name: 4-[N-[3-(3-aminopropylamino)propyl]-4-mercaptoanilino]benzenethiol IUPAC Name: 4-[N-[3-(3-aminopropylamino)propyl]-4-sulfanylanilino]benzenethiol Traditional Name: 4-[N-[3-(3-aminopropylamino)propyl]-4-mercapto-anilino]benzenethiol Formula: C18H25N3S2 MolecularWeight: 347.5412

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N(CCCNCCCN)C2=CC=C(C=C2)S)S

Isomeric SMILES

C1=CC(=CC=C1N(CCCNCCCN)C2=CC=C(C=C2)S)S

InChI

InChI=1S/C18H25N3S2/c19-11-1-12-20-13-2-14-21(15-3-7-17(22)8-4-15)16-5-9-18(23)10-6-16/h3-10,20,22-23H,1-2,11-14,19H2