(E)-3-[4-(2-bromophenyl)sulfanyl-3-chloranyl-phenyl]-1-(4-oxidanylpiperidin-1-yl)prop-2-en-1-one

Systemtic Name: (E)-3-[4-(2-bromophenyl)sulfanyl-3-chloranyl-phenyl]-1-(4-oxidanylpiperidin-1-yl)prop-2-en-1-one Openeye Name: (E)-3-[4-(2-bromophenyl)sulfanyl-3-chloro-phenyl]-1-(4-hydroxy-1-piperidyl)prop-2-en-1-one CAS Name: (E)-3-[4-[(2-bromophenyl)thio]-3-chlorophenyl]-1-(4-hydroxy-1-piperidinyl)-2-propen-1-one IUPAC Name: (E)-3-[4-(2-bromophenyl)sulfanyl-3-chlorophenyl]-1-(4-hydroxypiperidin-1-yl)prop-2-en-1-one Traditional Name: (E)-3-[4-[(2-bromophenyl)thio]-3-chloro-phenyl]-1-(4-hydroxypiperidino)prop-2-en-1-one Formula: C20H19BrClNO2S MolecularWeight: 452.79236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1O)C(=O)C=CC2=CC(=C(C=C2)SC3=CC=CC=C3Br)Cl

Isomeric SMILES

C1CN(CCC1O)C(=O)/C=C/C2=CC(=C(C=C2)SC3=CC=CC=C3Br)Cl

InChI

InChI=1S/C20H19BrClNO2S/c21-16-3-1-2-4-18(16)26-19-7-5-14(13-17(19)22)6-8-20(25)23-11-9-15(24)10-12-23/h1-8,13,15,24H,9-12H2/b8-6+