N-[5-[(3-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-cyano-3-(4-pentoxyphenyl)prop-2-enamide

Systemtic Name: N-[5-[(3-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-cyano-3-(4-pentoxyphenyl)prop-2-enamide Openeye Name: N-[5-[(3-chlorophenyl)methyl]thiazol-2-yl]-2-cyano-3-(4-pentoxyphenyl)prop-2-enamide CAS Name: N-[5-[(3-chlorophenyl)methyl]-2-thiazolyl]-2-cyano-3-(4-pentoxyphenyl)-2-propenamide IUPAC Name: N-[5-[(3-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-cyano-3-(4-pentoxyphenyl)prop-2-enamide Traditional Name: 3-(4-amoxyphenyl)-N-[5-(3-chlorobenzyl)thiazol-2-yl]-2-cyano-acrylamide Formula: C25H24ClN3O2S MolecularWeight: 465.99496

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=NC=C(S2)CC3=CC(=CC=C3)Cl

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=NC=C(S2)CC3=CC(=CC=C3)Cl

InChI

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