methyl 2-[2-(quinolin-2-ylcarbonylamino)-1,3-thiazol-4-yl]ethanoate

Systemtic Name: methyl 2-[2-(quinolin-2-ylcarbonylamino)-1,3-thiazol-4-yl]ethanoate Openeye Name: methyl 2-[2-(quinoline-2-carbonylamino)thiazol-4-yl]acetate CAS Name: 2-[2-[[oxo(2-quinolinyl)methyl]amino]-4-thiazolyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(quinoline-2-carbonylamino)-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-(quinaldoylamino)thiazol-4-yl]acetic acid methyl ester Formula: C16H13N3O3S MolecularWeight: 327.35772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CSC(=N1)NC(=O)C2=NC3=CC=CC=C3C=C2

Isomeric SMILES

COC(=O)CC1=CSC(=N1)NC(=O)C2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C16H13N3O3S/c1-22-14(20)8-11-9-23-16(17-11)19-15(21)13-7-6-10-4-2-3-5-12(10)18-13/h2-7,9H,8H2,1H3,(H,17,19,21)