1,4-bis[(2-ethoxy-5-propan-2-yl-phenyl)sulfonyl]-1,4-diazepane

Systemtic Name: 1,4-bis[(2-ethoxy-5-propan-2-yl-phenyl)sulfonyl]-1,4-diazepane Openeye Name: 1,4-bis[(2-ethoxy-5-isopropyl-phenyl)sulfonyl]-1,4-diazepane CAS Name: 1,4-bis[(2-ethoxy-5-propan-2-ylphenyl)sulfonyl]-1,4-diazepane IUPAC Name: 1,4-bis[(2-ethoxy-5-propan-2-ylphenyl)sulfonyl]-1,4-diazepane Traditional Name: 1,4-bis[(2-ethoxy-5-isopropyl-phenyl)sulfonyl]-1,4-diazepane Formula: C27H40N2O6S2 MolecularWeight: 552.7463

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C)C)S(=O)(=O)N2CCCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)C(C)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C)C)S(=O)(=O)N2CCCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)C(C)C)OCC

InChI

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