3-[(2-azanyl-4,5-dihydro-1,3-thiazol-4-yl)methyl]benzoic acid hydrochloride

Systemtic Name: 3-[(2-azanyl-4,5-dihydro-1,3-thiazol-4-yl)methyl]benzoic acid hydrochloride Openeye Name: 3-[(2-amino-4,5-dihydrothiazol-4-yl)methyl]benzoic acid hydrochloride CAS Name: 3-[(2-amino-4,5-dihydrothiazol-4-yl)methyl]benzoic acid hydrochloride IUPAC Name: 3-[(2-amino-4,5-dihydro-1,3-thiazol-4-yl)methyl]benzoic acid hydrochloride Traditional Name: 3-[(2-amino-2-thiazolin-4-yl)methyl]benzoic acid hydrochloride Formula: C11H13ClN2O2S MolecularWeight: 272.75112

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N=C(S1)N)CC2=CC=CC(=C2)C(=O)O.Cl

Isomeric SMILES

C1C(N=C(S1)N)CC2=CC=CC(=C2)C(=O)O.Cl

InChI

InChI=1S/C11H12N2O2S.ClH/c12-11-13-9(6-16-11)5-7-2-1-3-8(4-7)10(14)15;/h1-4,9H,5-6H2,(H2,12,13)(H,14,15);1H