(3R)-3-(2-aminophenyl)sulfanyl-3-(3-bromophenyl)-1-(4-methoxyphenyl)propan-1-one

Systemtic Name: (3R)-3-(2-aminophenyl)sulfanyl-3-(3-bromophenyl)-1-(4-methoxyphenyl)propan-1-one Openeye Name: (3R)-3-(2-aminophenyl)sulfanyl-3-(3-bromophenyl)-1-(4-methoxyphenyl)propan-1-one CAS Name: (3R)-3-[(2-aminophenyl)thio]-3-(3-bromophenyl)-1-(4-methoxyphenyl)-1-propanone IUPAC Name: (3R)-3-(2-aminophenyl)sulfanyl-3-(3-bromophenyl)-1-(4-methoxyphenyl)propan-1-one Traditional Name: (3R)-3-[(2-aminophenyl)thio]-3-(3-bromophenyl)-1-(4-methoxyphenyl)propan-1-one Formula: C22H20BrNO2S MolecularWeight: 442.3687

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)CC(C2=CC(=CC=C2)Br)SC3=CC=CC=C3N

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)C[C@H](C2=CC(=CC=C2)Br)SC3=CC=CC=C3N

InChI

InChI=1S/C22H20BrNO2S/c1-26-18-11-9-15(10-12-18)20(25)14-22(16-5-4-6-17(23)13-16)27-21-8-3-2-7-19(21)24/h2-13,22H,14,24H2,1H3/t22-/m1/s1