N-[5-[(4-bromophenyl)methyl]-1,3-thiazol-2-yl]-3-(4-tert-butylphenyl)-2-cyano-prop-2-enamide

Systemtic Name: N-[5-[(4-bromophenyl)methyl]-1,3-thiazol-2-yl]-3-(4-tert-butylphenyl)-2-cyano-prop-2-enamide Openeye Name: N-[5-[(4-bromophenyl)methyl]thiazol-2-yl]-3-(4-tert-butylphenyl)-2-cyano-prop-2-enamide CAS Name: N-[5-[(4-bromophenyl)methyl]-2-thiazolyl]-3-(4-tert-butylphenyl)-2-cyano-2-propenamide IUPAC Name: N-[5-[(4-bromophenyl)methyl]-1,3-thiazol-2-yl]-3-(4-tert-butylphenyl)-2-cyanoprop-2-enamide Traditional Name: N-[5-(4-bromobenzyl)thiazol-2-yl]-3-(4-tert-butylphenyl)-2-cyano-acrylamide Formula: C24H22BrN3OS MolecularWeight: 480.41998

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H22BrN3OS/c1-24(2,3)19-8-4-16(5-9-19)12-18(14-26)22(29)28-23-27-15-21(30-23)13-17-6-10-20(25)11-7-17/h4-12,15H,13H2,1-3H3,(H,27,28,29)