methyl 3-[(2-azanyl-1,3-thiazol-5-yl)methyl]-4-methyl-benzoate

Systemtic Name: methyl 3-[(2-azanyl-1,3-thiazol-5-yl)methyl]-4-methyl-benzoate Openeye Name: methyl 3-[(2-aminothiazol-5-yl)methyl]-4-methyl-benzoate CAS Name: 3-[(2-amino-5-thiazolyl)methyl]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[(2-amino-1,3-thiazol-5-yl)methyl]-4-methylbenzoate Traditional Name: 3-[(2-aminothiazol-5-yl)methyl]-4-methyl-benzoic acid methyl ester Formula: C13H14N2O2S MolecularWeight: 262.32746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)CC2=CN=C(S2)N

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)CC2=CN=C(S2)N

InChI

InChI=1S/C13H14N2O2S/c1-8-3-4-9(12(16)17-2)5-10(8)6-11-7-15-13(14)18-11/h3-5,7H,6H2,1-2H3,(H2,14,15)