N-tert-butyl-2-[2-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxidanylidene-ethyl]sulfanylbenzimidazol-1-yl]ethanamide

Systemtic Name: N-tert-butyl-2-[2-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxidanylidene-ethyl]sulfanylbenzimidazol-1-yl]ethanamide Openeye Name: N-tert-butyl-2-[2-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxo-ethyl]sulfanylbenzimidazol-1-yl]acetamide CAS Name: N-tert-butyl-2-[2-[[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl]thio]-1-benzimidazolyl]acetamide IUPAC Name: N-tert-butyl-2-[2-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl]sulfanylbenzimidazol-1-yl]acetamide Traditional Name: N-tert-butyl-2-[2-[[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-keto-ethyl]thio]benzimidazol-1-yl]acetamide Formula: C23H25N3O4S MolecularWeight: 439.5273

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN1C2=CC=CC=C2N=C1SCC(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC(C)(C)NC(=O)CN1C2=CC=CC=C2N=C1SCC(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C23H25N3O4S/c1-23(2,3)25-21(28)13-26-17-7-5-4-6-16(17)24-22(26)31-14-18(27)15-8-9-19-20(12-15)30-11-10-29-19/h4-9,12H,10-11,13-14H2,1-3H3,(H,25,28)