3-[[(2E)-2-[2-(2-chloranylethanoylamino)-1,3-thiazol-4-yl]-2-methoxyimino-ethanoyl]amino]-2-oxidanylidene-4-phenylsulfanyl-azetidine-1-sulfonate

Systemtic Name: 3-[[(2E)-2-[2-(2-chloranylethanoylamino)-1,3-thiazol-4-yl]-2-methoxyimino-ethanoyl]amino]-2-oxidanylidene-4-phenylsulfanyl-azetidine-1-sulfonate Openeye Name: 3-[[(2E)-2-[2-[(2-chloroacetyl)amino]thiazol-4-yl]-2-methoxyimino-acetyl]amino]-2-oxo-4-phenylsulfanyl-azetidine-1-sulfonate CAS Name: 3-[[(2E)-2-[2-[(2-chloro-1-oxoethyl)amino]-4-thiazolyl]-2-methoxyimino-1-oxoethyl]amino]-2-oxo-4-(phenylthio)-1-azetidinesulfonate IUPAC Name: 3-[[(2E)-2-[2-[(2-chloroacetyl)amino]-1,3-thiazol-4-yl]-2-methoxyiminoacetyl]amino]-2-oxo-4-phenylsulfanylazetidine-1-sulfonate Traditional Name: 3-[[(2E)-2-[2-[(2-chloroacetyl)amino]thiazol-4-yl]-2-methyloximino-acetyl]amino]-2-keto-4-(phenylthio)azetidine-1-sulfonate Formula: C17H15ClN5O7S3- MolecularWeight: 532.9783

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Descriptors Computed from Structure

Canonical SMILES:

CON=C(C1=CSC(=N1)NC(=O)CCl)C(=O)NC2C(N(C2=O)S(=O)(=O)[O-])SC3=CC=CC=C3

Isomeric SMILES

CO/N=C(\C1=CSC(=N1)NC(=O)CCl)/C(=O)NC2C(N(C2=O)S(=O)(=O)[O-])SC3=CC=CC=C3

InChI

InChI=1S/C17H16ClN5O7S3/c1-30-22-12(10-8-31-17(19-10)20-11(24)7-18)14(25)21-13-15(26)23(33(27,28)29)16(13)32-9-5-3-2-4-6-9/h2-6,8,13,16H,7H2,1H3,(H,21,25)(H,19,20,24)(H,27,28,29)/p-1/b22-12+