4-[2-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-ethyl-imidazol-2-yl]sulfanylethanoylamino]-N,N-diethyl-benzamide

Systemtic Name: 4-[2-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-ethyl-imidazol-2-yl]sulfanylethanoylamino]-N,N-diethyl-benzamide Openeye Name: 4-[[2-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-ethyl-imidazol-2-yl]sulfanylacetyl]amino]-N,N-diethyl-benzamide CAS Name: 4-[[2-[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-ethyl-2-imidazolyl]thio]-1-oxoethyl]amino]-N,N-diethylbenzamide IUPAC Name: 4-[[2-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-ethylimidazol-2-yl]sulfanylacetyl]amino]-N,N-diethylbenzamide Traditional Name: 4-[[2-[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-ethyl-imidazol-2-yl]thio]acetyl]amino]-N,N-diethyl-benzamide Formula: C26H30N4O4S MolecularWeight: 494.6058

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)N(CC)CC)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CCN1C(=CN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)N(CC)CC)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C26H30N4O4S/c1-4-29(5-2)25(32)18-7-10-20(11-8-18)28-24(31)17-35-26-27-16-21(30(26)6-3)19-9-12-22-23(15-19)34-14-13-33-22/h7-12,15-16H,4-6,13-14,17H2,1-3H3,(H,28,31)