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

Systemtic Name: 4-[5-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]sulfonylthiophen-2-yl]-2-methyl-1,3-thiazole Openeye Name: 4-[5-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]sulfonyl-2-thienyl]-2-methyl-thiazole CAS Name: 4-[5-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]sulfonyl]-2-thiophenyl]-2-methylthiazole IUPAC Name: 4-[5-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]sulfonylthiophen-2-yl]-2-methyl-1,3-thiazole Traditional Name: 2-methyl-4-[5-(4-piperonylpiperazino)sulfonyl-2-thienyl]thiazole Formula: C20H21N3O4S3 MolecularWeight: 463.59344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC=C(S2)S(=O)(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=NC(=CS1)C2=CC=C(S2)S(=O)(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C20H21N3O4S3/c1-14-21-16(12-28-14)19-4-5-20(29-19)30(24,25)23-8-6-22(7-9-23)11-15-2-3-17-18(10-15)27-13-26-17/h2-5,10,12H,6-9,11,13H2,1H3