2-[2-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]pyrrol-1-yl]-1,3-thiazole

Systemtic Name: 2-[2-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]pyrrol-1-yl]-1,3-thiazole Openeye Name: 2-[2-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]pyrrol-1-yl]thiazole CAS Name: 2-[2-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]methyl]-1-pyrrolyl]thiazole IUPAC Name: 2-[2-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]pyrrol-1-yl]-1,3-thiazole Traditional Name: 2-[2-[(4-piperonylpiperazino)methyl]pyrrol-1-yl]thiazole Formula: C20H22N4O2S MolecularWeight: 382.47928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)CC4=CC=CN4C5=NC=CS5

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)CC4=CC=CN4C5=NC=CS5

InChI

InChI=1S/C20H22N4O2S/c1-2-17(24(6-1)20-21-5-11-27-20)14-23-9-7-22(8-10-23)13-16-3-4-18-19(12-16)26-15-25-18/h1-6,11-12H,7-10,13-15H2