1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]-2-(1-ethylbenzimidazol-2-yl)sulfanyl-ethanone

Systemtic Name: 1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]-2-(1-ethylbenzimidazol-2-yl)sulfanyl-ethanone Openeye Name: 1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]-2-(1-ethylbenzimidazol-2-yl)sulfanyl-ethanone CAS Name: 1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-1-piperazinyl]-2-[(1-ethyl-2-benzimidazolyl)thio]ethanone IUPAC Name: 1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]-2-(1-ethylbenzimidazol-2-yl)sulfanylethanone Traditional Name: 1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazino]-2-[(1-ethylbenzimidazol-2-yl)thio]ethanone Formula: C24H28N4O3S MolecularWeight: 452.56912

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1SCC(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCCO5

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1SCC(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C24H28N4O3S/c1-2-28-20-6-4-3-5-19(20)25-24(28)32-17-23(29)27-11-9-26(10-12-27)16-18-7-8-21-22(15-18)31-14-13-30-21/h3-8,15H,2,9-14,16-17H2,1H3