N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-(1-ethylbenzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-(1-ethylbenzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-(1-ethylbenzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-[(1-ethyl-2-benzimidazolyl)thio]acetamide IUPAC Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-(1-ethylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-[(1-ethylbenzimidazol-2-yl)thio]acetamide Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1SCC(=O)NC(C)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1SCC(=O)NC(C)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H23N3O3S/c1-3-24-17-7-5-4-6-16(17)23-21(24)28-13-20(25)22-14(2)15-8-9-18-19(12-15)27-11-10-26-18/h4-9,12,14H,3,10-11,13H2,1-2H3,(H,22,25)