(2-cyclohexyliminopyridin-1-yl)-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperidin-4-yl]methanone

Systemtic Name: (2-cyclohexyliminopyridin-1-yl)-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperidin-4-yl]methanone Openeye Name: (2-cyclohexylimino-1-pyridyl)-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-4-piperidyl]methanone CAS Name: (2-cyclohexylimino-1-pyridinyl)-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-4-piperidinyl]methanone IUPAC Name: (2-cyclohexyliminopyridin-1-yl)-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperidin-4-yl]methanone Traditional Name: (2-cyclohexylimino-1-pyridyl)-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-4-piperidyl]methanone Formula: C26H33N3O5S MolecularWeight: 499.62232

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N=C2C=CC=CN2C(=O)C3CCN(CC3)S(=O)(=O)C4=CC5=C(C=C4)OCCCO5

Isomeric SMILES

C1CCC(CC1)N=C2C=CC=CN2C(=O)C3CCN(CC3)S(=O)(=O)C4=CC5=C(C=C4)OCCCO5

InChI

InChI=1S/C26H33N3O5S/c30-26(29-14-5-4-9-25(29)27-21-7-2-1-3-8-21)20-12-15-28(16-13-20)35(31,32)22-10-11-23-24(19-22)34-18-6-17-33-23/h4-5,9-11,14,19-21H,1-3,6-8,12-13,15-18H2