2-[2-[[4-(phenylmethyl)piperazin-1-ium-1-yl]methyl]pyrrol-1-yl]-1,3-thiazole

Systemtic Name: 2-[2-[[4-(phenylmethyl)piperazin-1-ium-1-yl]methyl]pyrrol-1-yl]-1,3-thiazole Openeye Name: 2-[2-[(4-benzylpiperazin-1-ium-1-yl)methyl]pyrrol-1-yl]thiazole CAS Name: 2-[2-[[4-(phenylmethyl)-1-piperazin-1-iumyl]methyl]-1-pyrrolyl]thiazole IUPAC Name: 2-[2-[(4-benzylpiperazin-1-ium-1-yl)methyl]pyrrol-1-yl]-1,3-thiazole Traditional Name: 2-[2-[(4-benzylpiperazin-1-ium-1-yl)methyl]pyrrol-1-yl]thiazole Formula: C19H23N4S+ MolecularWeight: 339.47772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CN2C3=NC=CS3)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CN2C3=NC=CS3)CC4=CC=CC=C4

InChI

InChI=1S/C19H22N4S/c1-2-5-17(6-3-1)15-21-10-12-22(13-11-21)16-18-7-4-9-23(18)19-20-8-14-24-19/h1-9,14H,10-13,15-16H2/p+1