2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[4-(4-ethylpiperazin-1-yl)phenyl]propanamide

Systemtic Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[4-(4-ethylpiperazin-1-yl)phenyl]propanamide Openeye Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[4-(4-ethylpiperazin-1-yl)phenyl]propanamide CAS Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[4-(4-ethyl-1-piperazinyl)phenyl]propanamide IUPAC Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[4-(4-ethylpiperazin-1-yl)phenyl]propanamide Traditional Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[4-(4-ethylpiperazino)phenyl]propionamide Formula: C24H32N4O5S MolecularWeight: 488.59968

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC=C(C=C2)NC(=O)C(C)NS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CCN1CCN(CC1)C2=CC=C(C=C2)NC(=O)C(C)NS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C24H32N4O5S/c1-3-27-11-13-28(14-12-27)20-7-5-19(6-8-20)25-24(29)18(2)26-34(30,31)21-9-10-22-23(17-21)33-16-4-15-32-22/h5-10,17-18,26H,3-4,11-16H2,1-2H3,(H,25,29)