methyl 3-[(2-azanyl-1,3-thiazol-5-yl)methyl]benzoate

Systemtic Name: methyl 3-[(2-azanyl-1,3-thiazol-5-yl)methyl]benzoate Openeye Name: methyl 3-[(2-aminothiazol-5-yl)methyl]benzoate CAS Name: 3-[(2-amino-5-thiazolyl)methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(2-amino-1,3-thiazol-5-yl)methyl]benzoate Traditional Name: 3-[(2-aminothiazol-5-yl)methyl]benzoic acid methyl ester Formula: C12H12N2O2S MolecularWeight: 248.30088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)CC2=CN=C(S2)N

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)CC2=CN=C(S2)N

InChI

InChI=1S/C12H12N2O2S/c1-16-11(15)9-4-2-3-8(5-9)6-10-7-14-12(13)17-10/h2-5,7H,6H2,1H3,(H2,13,14)