3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]propanamide

Systemtic Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]propanamide Openeye Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[[4-(1-piperidylmethyl)phenyl]methyl]propanamide CAS Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[[4-(1-piperidinylmethyl)phenyl]methyl]propanamide IUPAC Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]propanamide Traditional Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[4-(piperidinomethyl)benzyl]propionamide Formula: C25H33N3O5S MolecularWeight: 487.61162

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC=C(C=C2)CNC(=O)CCNS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

C1CCN(CC1)CC2=CC=C(C=C2)CNC(=O)CCNS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C25H33N3O5S/c29-25(26-18-20-5-7-21(8-6-20)19-28-13-2-1-3-14-28)11-12-27-34(30,31)22-9-10-23-24(17-22)33-16-4-15-32-23/h5-10,17,27H,1-4,11-16,18-19H2,(H,26,29)