ethyl 4-[5-[(E)-2-(5-benzamido-4-thiophen-2-yl-1,3-thiazol-2-yl)-2-cyano-ethenyl]furan-2-yl]benzoate

Systemtic Name: ethyl 4-[5-[(E)-2-(5-benzamido-4-thiophen-2-yl-1,3-thiazol-2-yl)-2-cyano-ethenyl]furan-2-yl]benzoate Openeye Name: ethyl 4-[5-[(E)-2-[5-benzamido-4-(2-thienyl)thiazol-2-yl]-2-cyano-vinyl]-2-furyl]benzoate CAS Name: 4-[5-[(E)-2-(5-benzamido-4-thiophen-2-yl-2-thiazolyl)-2-cyanoethenyl]-2-furanyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[5-[(E)-2-(5-benzamido-4-thiophen-2-yl-1,3-thiazol-2-yl)-2-cyanoethenyl]furan-2-yl]benzoate Traditional Name: 4-[5-[(E)-2-[5-benzamido-4-(2-thienyl)thiazol-2-yl]-2-cyano-vinyl]-2-furyl]benzoic acid ethyl ester Formula: C30H21N3O4S2 MolecularWeight: 551.63544

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=C(C#N)C3=NC(=C(S3)NC(=O)C4=CC=CC=C4)C5=CC=CS5

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)/C=C(\C#N)/C3=NC(=C(S3)NC(=O)C4=CC=CC=C4)C5=CC=CS5

InChI

InChI=1S/C30H21N3O4S2/c1-2-36-30(35)21-12-10-19(11-13-21)24-15-14-23(37-24)17-22(18-31)28-32-26(25-9-6-16-38-25)29(39-28)33-27(34)20-7-4-3-5-8-20/h3-17H,2H2,1H3,(H,33,34)/b22-17+