N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(1-ethylbenzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(1-ethylbenzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(1-ethylbenzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[(1-ethyl-2-benzimidazolyl)thio]acetamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(1-ethylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[(1-ethylbenzimidazol-2-yl)thio]acetamide Formula: C20H21N3O3S MolecularWeight: 383.46404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1SCC(=O)NC3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1SCC(=O)NC3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C20H21N3O3S/c1-2-23-16-7-4-3-6-15(16)22-20(23)27-13-19(24)21-14-8-9-17-18(12-14)26-11-5-10-25-17/h3-4,6-9,12H,2,5,10-11,13H2,1H3,(H,21,24)