(E)-3-(1-tert-butyl-2-sulfanylidene-pyridin-3-yl)-1-(4-chlorophenyl)prop-2-en-1-one

Systemtic Name: (E)-3-(1-tert-butyl-2-sulfanylidene-pyridin-3-yl)-1-(4-chlorophenyl)prop-2-en-1-one Openeye Name: (E)-3-(1-tert-butyl-2-thioxo-3-pyridyl)-1-(4-chlorophenyl)prop-2-en-1-one CAS Name: (E)-3-(1-tert-butyl-2-sulfanylidene-3-pyridinyl)-1-(4-chlorophenyl)-2-propen-1-one IUPAC Name: (E)-3-(1-tert-butyl-2-sulfanylidenepyridin-3-yl)-1-(4-chlorophenyl)prop-2-en-1-one Traditional Name: (E)-3-(1-tert-butyl-2-thioxo-3-pyridyl)-1-(4-chlorophenyl)prop-2-en-1-one Formula: C18H18ClNOS MolecularWeight: 331.85962

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C=CC=C(C1=S)C=CC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)(C)N1C=CC=C(C1=S)/C=C/C(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H18ClNOS/c1-18(2,3)20-12-4-5-14(17(20)22)8-11-16(21)13-6-9-15(19)10-7-13/h4-12H,1-3H3/b11-8+