1,4-bis[(2,3,4,5,6-pentamethylphenyl)sulfonyl]-1,4-diazepane

Systemtic Name: 1,4-bis[(2,3,4,5,6-pentamethylphenyl)sulfonyl]-1,4-diazepane Openeye Name: 1,4-bis[(2,3,4,5,6-pentamethylphenyl)sulfonyl]-1,4-diazepane CAS Name: 1,4-bis[(2,3,4,5,6-pentamethylphenyl)sulfonyl]-1,4-diazepane IUPAC Name: 1,4-bis[(2,3,4,5,6-pentamethylphenyl)sulfonyl]-1,4-diazepane Traditional Name: 1,4-bis[(2,3,4,5,6-pentamethylphenyl)sulfonyl]-1,4-diazepane Formula: C27H40N2O4S2 MolecularWeight: 520.7475

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C)C)S(=O)(=O)N2CCCN(CC2)S(=O)(=O)C3=C(C(=C(C(=C3C)C)C)C)C)C)C

Isomeric SMILES

CC1=C(C(=C(C(=C1C)C)S(=O)(=O)N2CCCN(CC2)S(=O)(=O)C3=C(C(=C(C(=C3C)C)C)C)C)C)C

InChI

InChI=1S/C27H40N2O4S2/c1-16-18(3)22(7)26(23(8)19(16)4)34(30,31)28-12-11-13-29(15-14-28)35(32,33)27-24(9)20(5)17(2)21(6)25(27)10/h11-15H2,1-10H3