4-[[4-(4-piperidin-4-ylphenyl)-1,3-thiazol-2-yl]amino]butanoic acid dihydrochloride

Systemtic Name: 4-[[4-(4-piperidin-4-ylphenyl)-1,3-thiazol-2-yl]amino]butanoic acid dihydrochloride Openeye Name: 4-[[4-[4-(4-piperidyl)phenyl]thiazol-2-yl]amino]butanoic acid dihydrochloride CAS Name: 4-[[4-[4-(4-piperidinyl)phenyl]-2-thiazolyl]amino]butanoic acid dihydrochloride IUPAC Name: 4-[[4-(4-piperidin-4-ylphenyl)-1,3-thiazol-2-yl]amino]butanoic acid dihydrochloride Traditional Name: 4-[[4-[4-(4-piperidyl)phenyl]thiazol-2-yl]amino]butyric acid dihydrochloride Formula: C18H25Cl2N3O2S MolecularWeight: 418.381

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C2=CC=C(C=C2)C3=CSC(=N3)NCCCC(=O)O.Cl.Cl

Isomeric SMILES

C1CNCCC1C2=CC=C(C=C2)C3=CSC(=N3)NCCCC(=O)O.Cl.Cl

InChI

InChI=1S/C18H23N3O2S.2ClH/c22-17(23)2-1-9-20-18-21-16(12-24-18)15-5-3-13(4-6-15)14-7-10-19-11-8-14;;/h3-6,12,14,19H,1-2,7-11H2,(H,20,21)(H,22,23);2*1H