1-[4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonyl-1,3-thiazolidin-3-yl]-3,3-dimethyl-butan-1-one

Systemtic Name: 1-[4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonyl-1,3-thiazolidin-3-yl]-3,3-dimethyl-butan-1-one Openeye Name: 1-[4-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]thiazolidin-3-yl]-3,3-dimethyl-butan-1-one CAS Name: 1-[4-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-oxomethyl]-3-thiazolidinyl]-3,3-dimethyl-1-butanone IUPAC Name: 1-[4-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-1,3-thiazolidin-3-yl]-3,3-dimethylbutan-1-one Traditional Name: 3,3-dimethyl-1-[4-(4-piperonylpiperazine-1-carbonyl)thiazolidin-3-yl]butan-1-one Formula: C22H31N3O4S MolecularWeight: 433.56424

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H31N3O4S/c1-22(2,3)11-20(26)25-14-30-13-17(25)21(27)24-8-6-23(7-9-24)12-16-4-5-18-19(10-16)29-15-28-18/h4-5,10,17H,6-9,11-15H2,1-3H3