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

Systemtic Name: butyl (E)-3-[2-[(3-chlorophenyl)-ethanoyl-amino]-1,3-thiazol-4-yl]-2-cyano-prop-2-enoate Openeye Name: butyl (E)-3-[2-(N-acetyl-3-chloro-anilino)thiazol-4-yl]-2-cyano-prop-2-enoate CAS Name: (E)-3-[2-(N-acetyl-3-chloroanilino)-4-thiazolyl]-2-cyano-2-propenoic acid butyl ester IUPAC Name: butyl (E)-3-[2-(N-acetyl-3-chloroanilino)-1,3-thiazol-4-yl]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[2-(N-acetyl-3-chloro-anilino)thiazol-4-yl]-2-cyano-acrylic acid butyl ester Formula: C19H18ClN3O3S MolecularWeight: 403.88252

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(=CC1=CSC(=N1)N(C2=CC(=CC=C2)Cl)C(=O)C)C#N

Isomeric SMILES

CCCCOC(=O)/C(=C/C1=CSC(=N1)N(C2=CC(=CC=C2)Cl)C(=O)C)/C#N

InChI

InChI=1S/C19H18ClN3O3S/c1-3-4-8-26-18(25)14(11-21)9-16-12-27-19(22-16)23(13(2)24)17-7-5-6-15(20)10-17/h5-7,9-10,12H,3-4,8H2,1-2H3/b14-9+