[2-(1,3-benzothiazol-2-ylamino)-2-oxidanylidene-ethyl] 3-[(2-methoxyphenyl)amino]propanoate

Systemtic Name: [2-(1,3-benzothiazol-2-ylamino)-2-oxidanylidene-ethyl] 3-[(2-methoxyphenyl)amino]propanoate Openeye Name: [2-(1,3-benzothiazol-2-ylamino)-2-oxo-ethyl] 3-(2-methoxyanilino)propanoate CAS Name: 3-(2-methoxyanilino)propanoic acid [2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl] 3-(2-methoxyanilino)propanoate Traditional Name: 3-(o-anisidino)propionic acid [2-(1,3-benzothiazol-2-ylamino)-2-keto-ethyl] ester Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NCCC(=O)OCC(=O)NC2=NC3=CC=CC=C3S2

Isomeric SMILES

COC1=CC=CC=C1NCCC(=O)OCC(=O)NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H19N3O4S/c1-25-15-8-4-2-6-13(15)20-11-10-18(24)26-12-17(23)22-19-21-14-7-3-5-9-16(14)27-19/h2-9,20H,10-12H2,1H3,(H,21,22,23)