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

Systemtic Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]ethanamide Openeye Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-[4-(4-methoxyphenyl)thiazol-2-yl]acetamide CAS Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-N-[4-(4-methoxyphenyl)-2-thiazolyl]acetamide IUPAC Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]acetamide Traditional Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-N-[4-(4-methoxyphenyl)thiazol-2-yl]acetamide Formula: C21H20N2O4S2 MolecularWeight: 428.5245

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CSC3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

COC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CSC3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C21H20N2O4S2/c1-25-15-5-3-14(4-6-15)17-12-29-21(22-17)23-20(24)13-28-16-7-8-18-19(11-16)27-10-2-9-26-18/h3-8,11-12H,2,9-10,13H2,1H3,(H,22,23,24)