1-[5-(azepan-1-ylsulfonyl)-2,4-dimethyl-phenyl]sulfonylazepane

Systemtic Name: 1-[5-(azepan-1-ylsulfonyl)-2,4-dimethyl-phenyl]sulfonylazepane Openeye Name: 1-[5-(azepan-1-ylsulfonyl)-2,4-dimethyl-phenyl]sulfonylazepane CAS Name: 1-[5-(1-azepanylsulfonyl)-2,4-dimethylphenyl]sulfonylazepane IUPAC Name: 1-[5-(azepan-1-ylsulfonyl)-2,4-dimethylphenyl]sulfonylazepane Traditional Name: 1-[5-(azepan-1-ylsulfonyl)-2,4-dimethyl-phenyl]sulfonylazepane Formula: C20H32N2O4S2 MolecularWeight: 428.60908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1S(=O)(=O)N2CCCCCC2)S(=O)(=O)N3CCCCCC3)C

Isomeric SMILES

CC1=CC(=C(C=C1S(=O)(=O)N2CCCCCC2)S(=O)(=O)N3CCCCCC3)C

InChI

InChI=1S/C20H32N2O4S2/c1-17-15-18(2)20(28(25,26)22-13-9-5-6-10-14-22)16-19(17)27(23,24)21-11-7-3-4-8-12-21/h15-16H,3-14H2,1-2H3