1-(3,5-dimethylpiperidin-1-yl)sulfonyl-4-(4-methylphenyl)sulfonyl-1,4-diazepane

Systemtic Name: 1-(3,5-dimethylpiperidin-1-yl)sulfonyl-4-(4-methylphenyl)sulfonyl-1,4-diazepane Openeye Name: 1-[(3,5-dimethyl-1-piperidyl)sulfonyl]-4-(p-tolylsulfonyl)-1,4-diazepane CAS Name: 1-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-4-(4-methylphenyl)sulfonyl-1,4-diazepane IUPAC Name: 1-(3,5-dimethylpiperidin-1-yl)sulfonyl-4-(4-methylphenyl)sulfonyl-1,4-diazepane Traditional Name: 1-(3,5-dimethylpiperidino)sulfonyl-4-tosyl-1,4-diazepane Formula: C19H31N3O4S2 MolecularWeight: 429.59714

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)N2CCCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)N2CCCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C)C

InChI

InChI=1S/C19H31N3O4S2/c1-16-5-7-19(8-6-16)27(23,24)20-9-4-10-21(12-11-20)28(25,26)22-14-17(2)13-18(3)15-22/h5-8,17-18H,4,9-15H2,1-3H3