1,6,11-tris(cyclopentylsulfonyl)-1,6,11-triazacyclopentadeca-3,8,13-triyne

Systemtic Name: 1,6,11-tris(cyclopentylsulfonyl)-1,6,11-triazacyclopentadeca-3,8,13-triyne Openeye Name: 1,6,11-tris(cyclopentylsulfonyl)-1,6,11-triazacyclopentadeca-3,8,13-triyne CAS Name: 1,6,11-tris(cyclopentylsulfonyl)-1,6,11-triazacyclopentadeca-3,8,13-triyne IUPAC Name: 1,6,11-tris(cyclopentylsulfonyl)-1,6,11-triazacyclopentadeca-3,8,13-triyne Traditional Name: 1,6,11-tris(cyclopentylsulfonyl)-1,6,11-triazacyclopentadeca-3,8,13-triyne Formula: C27H24N3O6S3 MolecularWeight: 582.69096

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Descriptors Computed from Structure

Canonical SMILES:

C1C#CCN(CC#CCN(CC#CCN1S(=O)(=O)[C]2[CH][CH][CH][CH]2)S(=O)(=O)[C]3[CH][CH][CH][CH]3)S(=O)(=O)[C]4[CH][CH][CH][CH]4

Isomeric SMILES

C1C#CCN(CC#CCN(CC#CCN1S(=O)(=O)[C]2[CH][CH][CH][CH]2)S(=O)(=O)[C]3[CH][CH][CH][CH]3)S(=O)(=O)[C]4[CH][CH][CH][CH]4

InChI

InChI=1S/C27H24N3O6S3/c31-37(32,25-13-1-2-14-25)28-19-7-9-21-29(38(33,34)26-15-3-4-16-26)23-11-12-24-30(22-10-8-20-28)39(35,36)27-17-5-6-18-27/h1-6,13-18H,19-24H2