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

Systemtic Name: 3-[2-[(5S)-4-oxidanylidene-2-phenylazanyl-1,3-thiazol-5-yl]ethanoylamino]benzoate Openeye Name: 3-[[2-[(5S)-2-anilino-4-oxo-thiazol-5-yl]acetyl]amino]benzoate CAS Name: 3-[[2-[(5S)-2-anilino-4-oxo-5-thiazolyl]-1-oxoethyl]amino]benzoate IUPAC Name: 3-[[2-[(5S)-2-anilino-4-oxo-1,3-thiazol-5-yl]acetyl]amino]benzoate Traditional Name: 3-[[2-[(5S)-2-anilino-4-keto-2-thiazolin-5-yl]acetyl]amino]benzoate Formula: C18H14N3O4S- MolecularWeight: 368.38646

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=O)C(S2)CC(=O)NC3=CC=CC(=C3)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=O)[C@@H](S2)CC(=O)NC3=CC=CC(=C3)C(=O)[O-]

InChI

InChI=1S/C18H15N3O4S/c22-15(19-13-8-4-5-11(9-13)17(24)25)10-14-16(23)21-18(26-14)20-12-6-2-1-3-7-12/h1-9,14H,10H2,(H,19,22)(H,24,25)(H,20,21,23)/p-1/t14-/m0/s1