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

Systemtic Name: 3-(4-butoxyphenyl)-N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-cyano-prop-2-enamide Openeye Name: 3-(4-butoxyphenyl)-N-[5-[(2-chlorophenyl)methyl]thiazol-2-yl]-2-cyano-prop-2-enamide CAS Name: 3-(4-butoxyphenyl)-N-[5-[(2-chlorophenyl)methyl]-2-thiazolyl]-2-cyano-2-propenamide IUPAC Name: 3-(4-butoxyphenyl)-N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-cyanoprop-2-enamide Traditional Name: 3-(4-butoxyphenyl)-N-[5-(2-chlorobenzyl)thiazol-2-yl]-2-cyano-acrylamide Formula: C24H22ClN3O2S MolecularWeight: 451.96838

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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=CC=C3Cl

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=NC=C(S2)CC3=CC=CC=C3Cl

InChI

InChI=1S/C24H22ClN3O2S/c1-2-3-12-30-20-10-8-17(9-11-20)13-19(15-26)23(29)28-24-27-16-21(31-24)14-18-6-4-5-7-22(18)25/h4-11,13,16H,2-3,12,14H2,1H3,(H,27,28,29)