2-[[3-(aminomethyl)phenyl]carbonyl-(2-azanyl-1,3-thiazol-4-yl)amino]ethanoic acid

Systemtic Name: 2-[[3-(aminomethyl)phenyl]carbonyl-(2-azanyl-1,3-thiazol-4-yl)amino]ethanoic acid Openeye Name: 2-[[3-(aminomethyl)benzoyl]-(2-aminothiazol-4-yl)amino]acetic acid CAS Name: 2-[[[3-(aminomethyl)phenyl]-oxomethyl]-(2-amino-4-thiazolyl)amino]acetic acid IUPAC Name: 2-[[3-(aminomethyl)benzoyl]-(2-amino-1,3-thiazol-4-yl)amino]acetic acid Traditional Name: 2-[[3-(aminomethyl)benzoyl]-(2-aminothiazol-4-yl)amino]acetic acid Formula: C13H14N4O3S MolecularWeight: 306.34026

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CN)C(=O)N(CC(=O)O)C2=CSC(=N2)N

Isomeric SMILES

C1=CC(=CC(=C1)CN)C(=O)N(CC(=O)O)C2=CSC(=N2)N

InChI

InChI=1S/C13H14N4O3S/c14-5-8-2-1-3-9(4-8)12(20)17(6-11(18)19)10-7-21-13(15)16-10/h1-4,7H,5-6,14H2,(H2,15,16)(H,18,19)