3-[(4-azanyl-2-thiophen-3-yl-phenyl)amino]propane-1,2-diol dihydrochloride

Systemtic Name: 3-[(4-azanyl-2-thiophen-3-yl-phenyl)amino]propane-1,2-diol dihydrochloride Openeye Name: 3-[4-amino-2-(3-thienyl)anilino]propane-1,2-diol dihydrochloride CAS Name: 3-[4-amino-2-(3-thiophenyl)anilino]propane-1,2-diol dihydrochloride IUPAC Name: 3-(4-amino-2-thiophen-3-ylanilino)propane-1,2-diol dihydrochloride Traditional Name: 3-[4-amino-2-(3-thienyl)anilino]propane-1,2-diol dihydrochloride Formula: C13H18Cl2N2O2S MolecularWeight: 337.26522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N)C2=CSC=C2)NCC(CO)O.Cl.Cl

Isomeric SMILES

C1=CC(=C(C=C1N)C2=CSC=C2)NCC(CO)O.Cl.Cl

InChI

InChI=1S/C13H16N2O2S.2ClH/c14-10-1-2-13(15-6-11(17)7-16)12(5-10)9-3-4-18-8-9;;/h1-5,8,11,15-17H,6-7,14H2;2*1H