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

Systemtic Name: ethyl 4-[5-[(E)-2-(1,3-benzothiazol-2-yl)ethenyl]furan-2-yl]benzoate Openeye Name: ethyl 4-[5-[(E)-2-(1,3-benzothiazol-2-yl)vinyl]-2-furyl]benzoate CAS Name: 4-[5-[(E)-2-(1,3-benzothiazol-2-yl)ethenyl]-2-furanyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[5-[(E)-2-(1,3-benzothiazol-2-yl)ethenyl]furan-2-yl]benzoate Traditional Name: 4-[5-[(E)-2-(1,3-benzothiazol-2-yl)vinyl]-2-furyl]benzoic acid ethyl ester Formula: C22H17NO3S MolecularWeight: 375.44028

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=CC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)/C=C/C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H17NO3S/c1-2-25-22(24)16-9-7-15(8-10-16)19-13-11-17(26-19)12-14-21-23-18-5-3-4-6-20(18)27-21/h3-14H,2H2,1H3/b14-12+