1-[4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonyl-1,3-thiazolidin-3-yl]-3-methyl-but-2-en-1-one

Systemtic Name: 1-[4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonyl-1,3-thiazolidin-3-yl]-3-methyl-but-2-en-1-one Openeye Name: 1-[4-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]thiazolidin-3-yl]-3-methyl-but-2-en-1-one CAS Name: 1-[4-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-oxomethyl]-3-thiazolidinyl]-3-methyl-2-buten-1-one IUPAC Name: 1-[4-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-1,3-thiazolidin-3-yl]-3-methylbut-2-en-1-one Traditional Name: 3-methyl-1-[4-(4-piperonylpiperazine-1-carbonyl)thiazolidin-3-yl]but-2-en-1-one Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)N1CSCC1C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC(=CC(=O)N1CSCC1C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C21H27N3O4S/c1-15(2)9-20(25)24-13-29-12-17(24)21(26)23-7-5-22(6-8-23)11-16-3-4-18-19(10-16)28-14-27-18/h3-4,9-10,17H,5-8,11-14H2,1-2H3