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

Systemtic Name: methyl 3-[2-(2-azanyl-4-oxidanylidene-1,3-thiazol-5-yl)ethanoylamino]benzoate Openeye Name: methyl 3-[[2-(2-amino-4-oxo-thiazol-5-yl)acetyl]amino]benzoate CAS Name: 3-[[2-(2-amino-4-oxo-5-thiazolyl)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-(2-amino-4-oxo-1,3-thiazol-5-yl)acetyl]amino]benzoate Traditional Name: 3-[[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=C1)NC(=O)CC2C(=O)N=C(S2)N

Isomeric SMILES

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

InChI

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