ethyl (3Z)-3-[1,3-benzothiazol-2-yl(ethanoyl)hydrazinylidene]-3-(2-methylphenyl)propanoate

Systemtic Name: ethyl (3Z)-3-[1,3-benzothiazol-2-yl(ethanoyl)hydrazinylidene]-3-(2-methylphenyl)propanoate Openeye Name: ethyl (3Z)-3-[acetyl(1,3-benzothiazol-2-yl)hydrazono]-3-(o-tolyl)propanoate CAS Name: (3Z)-3-[acetyl(1,3-benzothiazol-2-yl)hydrazinylidene]-3-(2-methylphenyl)propanoic acid ethyl ester IUPAC Name: ethyl (3Z)-3-[acetyl(1,3-benzothiazol-2-yl)hydrazinylidene]-3-(2-methylphenyl)propanoate Traditional Name: (3Z)-3-[acetyl(1,3-benzothiazol-2-yl)hydrazono]-3-(o-tolyl)propionic acid ethyl ester Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=NN(C1=NC2=CC=CC=C2S1)C(=O)C)C3=CC=CC=C3C

Isomeric SMILES

CCOC(=O)C/C(=N/N(C1=NC2=CC=CC=C2S1)C(=O)C)/C3=CC=CC=C3C

InChI

InChI=1S/C21H21N3O3S/c1-4-27-20(26)13-18(16-10-6-5-9-14(16)2)23-24(15(3)25)21-22-17-11-7-8-12-19(17)28-21/h5-12H,4,13H2,1-3H3/b23-18-