(Z)-2-(4-tert-butylphenyl)carbonyl-3-(2-pyridin-2-yl-1,3-thiazol-4-yl)prop-2-enenitrile

Systemtic Name: (Z)-2-(4-tert-butylphenyl)carbonyl-3-(2-pyridin-2-yl-1,3-thiazol-4-yl)prop-2-enenitrile Openeye Name: (Z)-2-(4-tert-butylbenzoyl)-3-[2-(2-pyridyl)thiazol-4-yl]prop-2-enenitrile CAS Name: (Z)-2-[(4-tert-butylphenyl)-oxomethyl]-3-[2-(2-pyridinyl)-4-thiazolyl]-2-propenenitrile IUPAC Name: (Z)-2-(4-tert-butylbenzoyl)-3-(2-pyridin-2-yl-1,3-thiazol-4-yl)prop-2-enenitrile Traditional Name: (Z)-2-(4-tert-butylbenzoyl)-3-[2-(2-pyridyl)thiazol-4-yl]acrylonitrile Formula: C22H19N3OS MolecularWeight: 373.47076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)C(=CC2=CSC(=N2)C3=CC=CC=N3)C#N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)/C(=C\C2=CSC(=N2)C3=CC=CC=N3)/C#N

InChI

InChI=1S/C22H19N3OS/c1-22(2,3)17-9-7-15(8-10-17)20(26)16(13-23)12-18-14-27-21(25-18)19-6-4-5-11-24-19/h4-12,14H,1-3H3/b16-12-