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

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-1-[4-(4-propan-2-yl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone Openeye Name: 2-(1,3-benzodioxol-5-yl)-1-[4-(4-isopropyl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone CAS Name: 2-(1,3-benzodioxol-5-yl)-1-[4-(4-propan-2-yl-1,3-benzothiazol-2-yl)-1-piperazinyl]ethanone IUPAC Name: 2-(1,3-benzodioxol-5-yl)-1-[4-(4-propan-2-yl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone Traditional Name: 2-(1,3-benzodioxol-5-yl)-1-[4-(4-isopropyl-1,3-benzothiazol-2-yl)piperazino]ethanone Formula: C23H25N3O3S MolecularWeight: 423.5279

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC(C)C1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H25N3O3S/c1-15(2)17-4-3-5-20-22(17)24-23(30-20)26-10-8-25(9-11-26)21(27)13-16-6-7-18-19(12-16)29-14-28-18/h3-7,12,15H,8-11,13-14H2,1-2H3