1-(2-aminophenyl)-3-azanyl-3-(4-azanylbutyl)-5-thiophen-2-yl-pentane-2,4-dione hydrochloride

Systemtic Name: 1-(2-aminophenyl)-3-azanyl-3-(4-azanylbutyl)-5-thiophen-2-yl-pentane-2,4-dione hydrochloride Openeye Name: 3-amino-3-(4-aminobutyl)-1-(2-aminophenyl)-5-(2-thienyl)pentane-2,4-dione hydrochloride CAS Name: 3-amino-3-(4-aminobutyl)-1-(2-aminophenyl)-5-thiophen-2-ylpentane-2,4-dione hydrochloride IUPAC Name: 3-amino-3-(4-aminobutyl)-1-(2-aminophenyl)-5-thiophen-2-ylpentane-2,4-dione hydrochloride Traditional Name: 3-amino-3-(4-aminobutyl)-1-(2-aminophenyl)-5-(2-thienyl)pentane-2,4-dione hydrochloride Formula: C19H26ClN3O2S MolecularWeight: 395.94664

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC(=O)C(CCCCN)(C(=O)CC2=CC=CS2)N)N.Cl

Isomeric SMILES

C1=CC=C(C(=C1)CC(=O)C(CCCCN)(C(=O)CC2=CC=CS2)N)N.Cl

InChI

InChI=1S/C19H25N3O2S.ClH/c20-10-4-3-9-19(22,18(24)13-15-7-5-11-25-15)17(23)12-14-6-1-2-8-16(14)21;/h1-2,5-8,11H,3-4,9-10,12-13,20-22H2;1H