N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[2-(1,3-thiazol-4-yl)benzimidazol-1-yl]ethanamide

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[2-(1,3-thiazol-4-yl)benzimidazol-1-yl]ethanamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(2-thiazol-4-ylbenzimidazol-1-yl)acetamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[2-(4-thiazolyl)-1-benzimidazolyl]acetamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[2-(1,3-thiazol-4-yl)benzimidazol-1-yl]acetamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(2-thiazol-4-ylbenzimidazol-1-yl)acetamide Formula: C21H18N4O3S MolecularWeight: 406.45762

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC(=O)CN3C4=CC=CC=C4N=C3C5=CSC=N5)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC(=O)CN3C4=CC=CC=C4N=C3C5=CSC=N5)OC1

InChI

InChI=1S/C21H18N4O3S/c26-20(23-14-6-7-18-19(10-14)28-9-3-8-27-18)11-25-17-5-2-1-4-15(17)24-21(25)16-12-29-13-22-16/h1-2,4-7,10,12-13H,3,8-9,11H2,(H,23,26)