1,4-bis[(5-tert-butyl-2-methoxy-phenyl)sulfonyl]-1,4-diazepane

Systemtic Name: 1,4-bis[(5-tert-butyl-2-methoxy-phenyl)sulfonyl]-1,4-diazepane Openeye Name: 1,4-bis[(5-tert-butyl-2-methoxy-phenyl)sulfonyl]-1,4-diazepane CAS Name: 1,4-bis[(5-tert-butyl-2-methoxyphenyl)sulfonyl]-1,4-diazepane IUPAC Name: 1,4-bis[(5-tert-butyl-2-methoxyphenyl)sulfonyl]-1,4-diazepane Traditional Name: 1,4-bis[(5-tert-butyl-2-methoxy-phenyl)sulfonyl]-1,4-diazepane Formula: C27H40N2O6S2 MolecularWeight: 552.7463

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OC)S(=O)(=O)N2CCCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)C(C)(C)C)OC

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OC)S(=O)(=O)N2CCCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)C(C)(C)C)OC

InChI

InChI=1S/C27H40N2O6S2/c1-26(2,3)20-10-12-22(34-7)24(18-20)36(30,31)28-14-9-15-29(17-16-28)37(32,33)25-19-21(27(4,5)6)11-13-23(25)35-8/h10-13,18-19H,9,14-17H2,1-8H3