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

Systemtic Name: 2-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1,3-thiazol-2-yl]-N-(3-methylphenyl)ethanamide Openeye Name: 2-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)thiazol-2-yl]-N-(m-tolyl)acetamide CAS Name: 2-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-thiazolyl]-N-(3-methylphenyl)acetamide IUPAC Name: 2-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1,3-thiazol-2-yl]-N-(3-methylphenyl)acetamide Traditional Name: 2-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)thiazol-2-yl]-N-(m-tolyl)acetamide Formula: C21H20N2O3S MolecularWeight: 380.4601

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CC2=NC(=CS2)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CC2=NC(=CS2)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C21H20N2O3S/c1-14-4-2-5-16(10-14)22-20(24)12-21-23-17(13-27-21)15-6-7-18-19(11-15)26-9-3-8-25-18/h2,4-7,10-11,13H,3,8-9,12H2,1H3,(H,22,24)