1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N-(5-ethanoyl-4-phenyl-1,3-thiazol-2-yl)piperidine-4-carboxamide

Systemtic Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N-(5-ethanoyl-4-phenyl-1,3-thiazol-2-yl)piperidine-4-carboxamide Openeye Name: N-(5-acetyl-4-phenyl-thiazol-2-yl)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperidine-4-carboxamide CAS Name: N-(5-acetyl-4-phenyl-2-thiazolyl)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-(5-acetyl-4-phenyl-1,3-thiazol-2-yl)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperidine-4-carboxamide Traditional Name: N-(5-acetyl-4-phenyl-thiazol-2-yl)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)isonipecotamide Formula: C26H27N3O6S2 MolecularWeight: 541.63908

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(N=C(S1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCCO4)C5=CC=CC=C5

Isomeric SMILES

CC(=O)C1=C(N=C(S1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCCO4)C5=CC=CC=C5

InChI

InChI=1S/C26H27N3O6S2/c1-17(30)24-23(18-6-3-2-4-7-18)27-26(36-24)28-25(31)19-10-12-29(13-11-19)37(32,33)20-8-9-21-22(16-20)35-15-5-14-34-21/h2-4,6-9,16,19H,5,10-15H2,1H3,(H,27,28,31)