1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-(2-propan-2-yl-1,3-thiazol-4-yl)ethanone

Systemtic Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-(2-propan-2-yl-1,3-thiazol-4-yl)ethanone Openeye Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-(2-isopropylthiazol-4-yl)ethanone CAS Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-2-(2-propan-2-yl-4-thiazolyl)ethanone IUPAC Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-(2-propan-2-yl-1,3-thiazol-4-yl)ethanone Traditional Name: 2-(2-isopropylthiazol-4-yl)-1-(4-piperonylpiperazino)ethanone Formula: C20H25N3O3S MolecularWeight: 387.4958

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=CS1)CC(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C)C1=NC(=CS1)CC(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H25N3O3S/c1-14(2)20-21-16(12-27-20)10-19(24)23-7-5-22(6-8-23)11-15-3-4-17-18(9-15)26-13-25-17/h3-4,9,12,14H,5-8,10-11,13H2,1-2H3