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

Systemtic Name: N-cyclopentyl-2-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-ethyl-imidazol-2-yl]sulfanyl-propanamide Openeye Name: N-cyclopentyl-2-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-ethyl-imidazol-2-yl]sulfanyl-propanamide CAS Name: N-cyclopentyl-2-[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-ethyl-2-imidazolyl]thio]propanamide IUPAC Name: N-cyclopentyl-2-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-ethylimidazol-2-yl]sulfanylpropanamide Traditional Name: N-cyclopentyl-2-[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-ethyl-imidazol-2-yl]thio]propionamide Formula: C21H27N3O3S MolecularWeight: 401.52238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CN=C1SC(C)C(=O)NC2CCCC2)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CCN1C(=CN=C1SC(C)C(=O)NC2CCCC2)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H27N3O3S/c1-3-24-17(15-8-9-18-19(12-15)27-11-10-26-18)13-22-21(24)28-14(2)20(25)23-16-6-4-5-7-16/h8-9,12-14,16H,3-7,10-11H2,1-2H3,(H,23,25)