(E)-3-phenyl-1-[4-(4,6,6-trimethyl-2-sulfanylidene-1H-pyrimidin-3-yl)phenyl]prop-2-en-1-one

Systemtic Name: (E)-3-phenyl-1-[4-(4,6,6-trimethyl-2-sulfanylidene-1H-pyrimidin-3-yl)phenyl]prop-2-en-1-one Openeye Name: (E)-3-phenyl-1-[4-(4,6,6-trimethyl-2-thioxo-1H-pyrimidin-3-yl)phenyl]prop-2-en-1-one CAS Name: (E)-3-phenyl-1-[4-(4,6,6-trimethyl-2-sulfanylidene-1H-pyrimidin-3-yl)phenyl]-2-propen-1-one IUPAC Name: (E)-3-phenyl-1-[4-(4,6,6-trimethyl-2-sulfanylidene-1H-pyrimidin-3-yl)phenyl]prop-2-en-1-one Traditional Name: (E)-3-phenyl-1-[4-(4,6,6-trimethyl-2-thioxo-1H-pyrimidin-3-yl)phenyl]prop-2-en-1-one Formula: C22H22N2OS MolecularWeight: 362.48788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(NC(=S)N1C2=CC=C(C=C2)C(=O)C=CC3=CC=CC=C3)(C)C

Isomeric SMILES

CC1=CC(NC(=S)N1C2=CC=C(C=C2)C(=O)/C=C/C3=CC=CC=C3)(C)C

InChI

InChI=1S/C22H22N2OS/c1-16-15-22(2,3)23-21(26)24(16)19-12-10-18(11-13-19)20(25)14-9-17-7-5-4-6-8-17/h4-15H,1-3H3,(H,23,26)/b14-9+