5-[(E)-3-methylsulfanylbut-1-enyl]-2,3-diphenyl-6-[phenyl(prop-2-enyl)amino]pyrimidin-4-one

Systemtic Name: 5-[(E)-3-methylsulfanylbut-1-enyl]-2,3-diphenyl-6-[phenyl(prop-2-enyl)amino]pyrimidin-4-one Openeye Name: 6-(N-allylanilino)-5-[(E)-3-methylsulfanylbut-1-enyl]-2,3-diphenyl-pyrimidin-4-one CAS Name: 5-[(E)-3-(methylthio)but-1-enyl]-2,3-diphenyl-6-(N-prop-2-enylanilino)-4-pyrimidinone IUPAC Name: 5-[(E)-3-methylsulfanylbut-1-enyl]-2,3-diphenyl-6-(N-prop-2-enylanilino)pyrimidin-4-one Traditional Name: 6-(N-allylanilino)-5-[(E)-3-(methylthio)but-1-enyl]-2,3-diphenyl-pyrimidin-4-one Formula: C30H29N3OS MolecularWeight: 479.63576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C=CC1=C(N=C(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)N(CC=C)C4=CC=CC=C4)SC

Isomeric SMILES

CC(/C=C/C1=C(N=C(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)N(CC=C)C4=CC=CC=C4)SC

InChI

InChI=1S/C30H29N3OS/c1-4-22-32(25-16-10-6-11-17-25)29-27(21-20-23(2)35-3)30(34)33(26-18-12-7-13-19-26)28(31-29)24-14-8-5-9-15-24/h4-21,23H,1,22H2,2-3H3/b21-20+