[2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxidanylidene-ethyl] (2R)-2-phenylbutanoate

Systemtic Name: [2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxidanylidene-ethyl] (2R)-2-phenylbutanoate Openeye Name: [2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxo-ethyl] (2R)-2-phenylbutanoate CAS Name: (2R)-2-phenylbutanoic acid [2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxoethyl] (2R)-2-phenylbutanoate Traditional Name: (2R)-2-phenylbutyric acid [2-keto-2-(piazthiol-4-ylamino)ethyl] ester Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)OCC(=O)NC2=CC=CC3=NSN=C32

Isomeric SMILES

CC[C@H](C1=CC=CC=C1)C(=O)OCC(=O)NC2=CC=CC3=NSN=C32

InChI

InChI=1S/C18H17N3O3S/c1-2-13(12-7-4-3-5-8-12)18(23)24-11-16(22)19-14-9-6-10-15-17(14)21-25-20-15/h3-10,13H,2,11H2,1H3,(H,19,22)/t13-/m1/s1