(2-acetamido-1,3-thiazol-4-yl)methyl 3-azanyl-4-chloranyl-benzoate

Systemtic Name: (2-acetamido-1,3-thiazol-4-yl)methyl 3-azanyl-4-chloranyl-benzoate Openeye Name: (2-acetamidothiazol-4-yl)methyl 3-amino-4-chloro-benzoate CAS Name: 3-amino-4-chlorobenzoic acid (2-acetamido-4-thiazolyl)methyl ester IUPAC Name: (2-acetamido-1,3-thiazol-4-yl)methyl 3-amino-4-chlorobenzoate Traditional Name: 3-amino-4-chloro-benzoic acid (2-acetamidothiazol-4-yl)methyl ester Formula: C13H12ClN3O3S MolecularWeight: 325.77068

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=CS1)COC(=O)C2=CC(=C(C=C2)Cl)N

Isomeric SMILES

CC(=O)NC1=NC(=CS1)COC(=O)C2=CC(=C(C=C2)Cl)N

InChI

InChI=1S/C13H12ClN3O3S/c1-7(18)16-13-17-9(6-21-13)5-20-12(19)8-2-3-10(14)11(15)4-8/h2-4,6H,5,15H2,1H3,(H,16,17,18)