N-[2-[4-(3-cyclopentylpropanoyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-N-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide

Systemtic Name: N-[2-[4-(3-cyclopentylpropanoyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-N-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-[2-[4-(3-cyclopentylpropanoyl)piperazin-1-yl]-2-oxo-ethyl]-N-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-[2-[4-(3-cyclopentyl-1-oxopropyl)-1-piperazinyl]-2-oxoethyl]-N-methyl-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-[2-[4-(3-cyclopentylpropanoyl)piperazin-1-yl]-2-oxoethyl]-N-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-[2-[4-(3-cyclopentylpropanoyl)piperazino]-2-keto-ethyl]-N-methyl-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C24H35N3O6S MolecularWeight: 493.6162

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)N1CCN(CC1)C(=O)CCC2CCCC2)S(=O)(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CN(CC(=O)N1CCN(CC1)C(=O)CCC2CCCC2)S(=O)(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C24H35N3O6S/c1-25(34(30,31)20-8-9-21-22(17-20)33-16-4-15-32-21)18-24(29)27-13-11-26(12-14-27)23(28)10-7-19-5-2-3-6-19/h8-9,17,19H,2-7,10-16,18H2,1H3