4-(1H-benzimidazol-2-ylsulfanyl)-1-(4-phenylpiperazin-1-yl)butan-1-one

Systemtic Name: 4-(1H-benzimidazol-2-ylsulfanyl)-1-(4-phenylpiperazin-1-yl)butan-1-one Openeye Name: 4-(1H-benzimidazol-2-ylsulfanyl)-1-(4-phenylpiperazin-1-yl)butan-1-one CAS Name: 4-(1H-benzimidazol-2-ylthio)-1-(4-phenyl-1-piperazinyl)-1-butanone IUPAC Name: 4-(1H-benzimidazol-2-ylsulfanyl)-1-(4-phenylpiperazin-1-yl)butan-1-one Traditional Name: 4-(1H-benzimidazol-2-ylthio)-1-(4-phenylpiperazino)butan-1-one Formula: C21H24N4OS MolecularWeight: 380.50646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)CCCSC3=NC4=CC=CC=C4N3

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)CCCSC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C21H24N4OS/c26-20(25-14-12-24(13-15-25)17-7-2-1-3-8-17)11-6-16-27-21-22-18-9-4-5-10-19(18)23-21/h1-5,7-10H,6,11-16H2,(H,22,23)