(E)-1-(4-tert-butylphenyl)-3-(1-prop-2-enyl-2-sulfanylidene-pyridin-3-yl)prop-2-en-1-one

Systemtic Name: (E)-1-(4-tert-butylphenyl)-3-(1-prop-2-enyl-2-sulfanylidene-pyridin-3-yl)prop-2-en-1-one Openeye Name: (E)-3-(1-allyl-2-thioxo-3-pyridyl)-1-(4-tert-butylphenyl)prop-2-en-1-one CAS Name: (E)-1-(4-tert-butylphenyl)-3-(1-prop-2-enyl-2-sulfanylidene-3-pyridinyl)-2-propen-1-one IUPAC Name: (E)-1-(4-tert-butylphenyl)-3-(1-prop-2-enyl-2-sulfanylidenepyridin-3-yl)prop-2-en-1-one Traditional Name: (E)-3-(1-allyl-2-thioxo-3-pyridyl)-1-(4-tert-butylphenyl)prop-2-en-1-one Formula: C21H23NOS MolecularWeight: 337.47842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)C=CC2=CC=CN(C2=S)CC=C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)/C=C/C2=CC=CN(C2=S)CC=C

InChI

InChI=1S/C21H23NOS/c1-5-14-22-15-6-7-17(20(22)24)10-13-19(23)16-8-11-18(12-9-16)21(2,3)4/h5-13,15H,1,14H2,2-4H3/b13-10+