ethyl 4-[5-[(E)-(1,3-benzothiazol-2-ylhydrazinylidene)methyl]furan-2-yl]benzoate

Systemtic Name: ethyl 4-[5-[(E)-(1,3-benzothiazol-2-ylhydrazinylidene)methyl]furan-2-yl]benzoate Openeye Name: ethyl 4-[5-[(E)-(1,3-benzothiazol-2-ylhydrazono)methyl]-2-furyl]benzoate CAS Name: 4-[5-[(E)-(1,3-benzothiazol-2-ylhydrazinylidene)methyl]-2-furanyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[5-[(E)-(1,3-benzothiazol-2-ylhydrazinylidene)methyl]furan-2-yl]benzoate Traditional Name: 4-[5-[(E)-(1,3-benzothiazol-2-ylhydrazono)methyl]-2-furyl]benzoic acid ethyl ester Formula: C21H17N3O3S MolecularWeight: 391.44298

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=NNC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)/C=N/NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H17N3O3S/c1-2-26-20(25)15-9-7-14(8-10-15)18-12-11-16(27-18)13-22-24-21-23-17-5-3-4-6-19(17)28-21/h3-13H,2H2,1H3,(H,23,24)/b22-13+