3-(4-butoxyphenyl)-N-[5-[(3-chloranyl-4-methyl-phenyl)methyl]-1,3-thiazol-2-yl]-2-cyano-prop-2-enamide

Systemtic Name: 3-(4-butoxyphenyl)-N-[5-[(3-chloranyl-4-methyl-phenyl)methyl]-1,3-thiazol-2-yl]-2-cyano-prop-2-enamide Openeye Name: 3-(4-butoxyphenyl)-N-[5-[(3-chloro-4-methyl-phenyl)methyl]thiazol-2-yl]-2-cyano-prop-2-enamide CAS Name: 3-(4-butoxyphenyl)-N-[5-[(3-chloro-4-methylphenyl)methyl]-2-thiazolyl]-2-cyano-2-propenamide IUPAC Name: 3-(4-butoxyphenyl)-N-[5-[(3-chloro-4-methylphenyl)methyl]-1,3-thiazol-2-yl]-2-cyanoprop-2-enamide Traditional Name: 3-(4-butoxyphenyl)-N-[5-(3-chloro-4-methyl-benzyl)thiazol-2-yl]-2-cyano-acrylamide Formula: C25H24ClN3O2S MolecularWeight: 465.99496

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=NC=C(S2)CC3=CC(=C(C=C3)C)Cl

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=NC=C(S2)CC3=CC(=C(C=C3)C)Cl

InChI

InChI=1S/C25H24ClN3O2S/c1-3-4-11-31-21-9-7-18(8-10-21)12-20(15-27)24(30)29-25-28-16-22(32-25)13-19-6-5-17(2)23(26)14-19/h5-10,12,14,16H,3-4,11,13H2,1-2H3,(H,28,29,30)