2-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-ethyl-imidazol-2-yl]sulfanyl-N-pentan-2-yl-ethanamide

Systemtic Name: 2-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-ethyl-imidazol-2-yl]sulfanyl-N-pentan-2-yl-ethanamide Openeye Name: 2-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-ethyl-imidazol-2-yl]sulfanyl-N-(1-methylbutyl)acetamide CAS Name: 2-[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-ethyl-2-imidazolyl]thio]-N-pentan-2-ylacetamide IUPAC Name: 2-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-ethylimidazol-2-yl]sulfanyl-N-pentan-2-ylacetamide Traditional Name: 2-[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-ethyl-imidazol-2-yl]thio]-N-(1-methylbutyl)acetamide Formula: C20H27N3O3S MolecularWeight: 389.51168

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)CSC1=NC=C(N1CC)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CCCC(C)NC(=O)CSC1=NC=C(N1CC)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C20H27N3O3S/c1-4-6-14(3)22-19(24)13-27-20-21-12-16(23(20)5-2)15-7-8-17-18(11-15)26-10-9-25-17/h7-8,11-12,14H,4-6,9-10,13H2,1-3H3,(H,22,24)