propan-2-yl (E)-2-cyano-3-[2-[(3,4-dimethylphenyl)-ethanoyl-amino]-1,3-thiazol-4-yl]prop-2-enoate

Systemtic Name: propan-2-yl (E)-2-cyano-3-[2-[(3,4-dimethylphenyl)-ethanoyl-amino]-1,3-thiazol-4-yl]prop-2-enoate Openeye Name: isopropyl (E)-3-[2-(N-acetyl-3,4-dimethyl-anilino)thiazol-4-yl]-2-cyano-prop-2-enoate CAS Name: (E)-3-[2-(N-acetyl-3,4-dimethylanilino)-4-thiazolyl]-2-cyano-2-propenoic acid propan-2-yl ester IUPAC Name: propan-2-yl (E)-3-[2-(N-acetyl-3,4-dimethylanilino)-1,3-thiazol-4-yl]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[2-(N-acetyl-3,4-dimethyl-anilino)thiazol-4-yl]-2-cyano-acrylic acid isopropyl ester Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N(C2=NC(=CS2)C=C(C#N)C(=O)OC(C)C)C(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N(C2=NC(=CS2)/C=C(\C#N)/C(=O)OC(C)C)C(=O)C)C

InChI

InChI=1S/C20H21N3O3S/c1-12(2)26-19(25)16(10-21)9-17-11-27-20(22-17)23(15(5)24)18-7-6-13(3)14(4)8-18/h6-9,11-12H,1-5H3/b16-9+