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

Systemtic Name: 2-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanylmethyl)-1,3-thiazol-2-yl]-N-(4-methylphenyl)ethanamide Openeye Name: 2-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanylmethyl)thiazol-2-yl]-N-(p-tolyl)acetamide CAS Name: 2-[4-[(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)methyl]-2-thiazolyl]-N-(4-methylphenyl)acetamide IUPAC Name: 2-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanylmethyl)-1,3-thiazol-2-yl]-N-(4-methylphenyl)acetamide Traditional Name: 2-[4-[(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)methyl]thiazol-2-yl]-N-(p-tolyl)acetamide Formula: C22H22N2O3S2 MolecularWeight: 426.55168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CC2=NC(=CS2)CSC3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CC2=NC(=CS2)CSC3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C22H22N2O3S2/c1-15-3-5-16(6-4-15)23-21(25)12-22-24-17(14-29-22)13-28-18-7-8-19-20(11-18)27-10-2-9-26-19/h3-8,11,14H,2,9-10,12-13H2,1H3,(H,23,25)