ethyl 4-[(6-ethyl-1,3-benzothiazol-2-yl)amino]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[(6-ethyl-1,3-benzothiazol-2-yl)amino]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[(6-ethyl-1,3-benzothiazol-2-yl)amino]-4-oxo-butanoate CAS Name: 4-[(6-ethyl-1,3-benzothiazol-2-yl)amino]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[(6-ethyl-1,3-benzothiazol-2-yl)amino]-4-oxobutanoate Traditional Name: 4-[(6-ethyl-1,3-benzothiazol-2-yl)amino]-4-keto-butyric acid ethyl ester Formula: C15H18N2O3S MolecularWeight: 306.38002

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)CCC(=O)OCC

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)CCC(=O)OCC

InChI

InChI=1S/C15H18N2O3S/c1-3-10-5-6-11-12(9-10)21-15(16-11)17-13(18)7-8-14(19)20-4-2/h5-6,9H,3-4,7-8H2,1-2H3,(H,16,17,18)