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

Systemtic Name: methyl 2-[2-(2-azanyl-4-oxidanylidene-1,3-thiazol-5-yl)ethanoylamino]benzoate Openeye Name: methyl 2-[[2-(2-amino-4-oxo-thiazol-5-yl)acetyl]amino]benzoate CAS Name: 2-[[2-(2-amino-4-oxo-5-thiazolyl)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-(2-amino-4-oxo-1,3-thiazol-5-yl)acetyl]amino]benzoate Traditional Name: 2-[[2-(2-amino-4-keto-2-thiazolin-5-yl)acetyl]amino]benzoic acid methyl ester Formula: C13H13N3O4S MolecularWeight: 307.32502

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)CC2C(=O)N=C(S2)N

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)CC2C(=O)N=C(S2)N

InChI

InChI=1S/C13H13N3O4S/c1-20-12(19)7-4-2-3-5-8(7)15-10(17)6-9-11(18)16-13(14)21-9/h2-5,9H,6H2,1H3,(H,15,17)(H2,14,16,18)