2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-(6-methoxy-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-(6-methoxy-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamide Formula: C19H18N2O4S2 MolecularWeight: 402.48722

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C19H18N2O4S2/c1-23-12-3-5-14-17(9-12)27-19(20-14)21-18(22)11-26-13-4-6-15-16(10-13)25-8-2-7-24-15/h3-6,9-10H,2,7-8,11H2,1H3,(H,20,21,22)