4-(dimethylamino)-1,3-bis(phenylmethylsulfanyl)but-3-en-2-one

Systemtic Name: 4-(dimethylamino)-1,3-bis(phenylmethylsulfanyl)but-3-en-2-one Openeye Name: 1,3-bis(benzylsulfanyl)-4-(dimethylamino)but-3-en-2-one CAS Name: 4-(dimethylamino)-1,3-bis(phenylmethylthio)-3-buten-2-one IUPAC Name: 1,3-bis(benzylsulfanyl)-4-(dimethylamino)but-3-en-2-one Traditional Name: 1,3-bis(benzylthio)-4-(dimethylamino)but-3-en-2-one Formula: C20H23NOS2 MolecularWeight: 357.53272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C=C(C(=O)CSCC1=CC=CC=C1)SCC2=CC=CC=C2

Isomeric SMILES

CN(C)C=C(C(=O)CSCC1=CC=CC=C1)SCC2=CC=CC=C2

InChI

InChI=1S/C20H23NOS2/c1-21(2)13-20(24-15-18-11-7-4-8-12-18)19(22)16-23-14-17-9-5-3-6-10-17/h3-13H,14-16H2,1-2H3