ethyl 4-cyano-3-phenyl-2-(5-phenyl-1,3-thiazol-2-yl)-2,3-dihydropyrrole-4-carboxylate

Systemtic Name: ethyl 4-cyano-3-phenyl-2-(5-phenyl-1,3-thiazol-2-yl)-2,3-dihydropyrrole-4-carboxylate Openeye Name: ethyl 4-cyano-3-phenyl-2-(5-phenylthiazol-2-yl)-2,3-dihydropyrrole-4-carboxylate CAS Name: 4-cyano-3-phenyl-2-(5-phenyl-2-thiazolyl)-2,3-dihydropyrrole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 4-cyano-3-phenyl-2-(5-phenyl-1,3-thiazol-2-yl)-2,3-dihydropyrrole-4-carboxylate Traditional Name: 3-cyano-4-phenyl-5-(5-phenylthiazol-2-yl)-1-pyrroline-3-carboxylic acid ethyl ester Formula: C23H19N3O2S MolecularWeight: 401.48086

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C=NC(C1C2=CC=CC=C2)C3=NC=C(S3)C4=CC=CC=C4)C#N

Isomeric SMILES

CCOC(=O)C1(C=NC(C1C2=CC=CC=C2)C3=NC=C(S3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C23H19N3O2S/c1-2-28-22(27)23(14-24)15-26-20(19(23)17-11-7-4-8-12-17)21-25-13-18(29-21)16-9-5-3-6-10-16/h3-13,15,19-20H,2H2,1H3