N-[3-(azepan-1-ylsulfonyl)phenyl]-4-tert-butyl-cyclohexane-1-carboxamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-4-tert-butyl-cyclohexane-1-carboxamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-4-tert-butyl-cyclohexanecarboxamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-4-tert-butyl-1-cyclohexanecarboxamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-4-tert-butylcyclohexane-1-carboxamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-4-tert-butyl-cyclohexanecarboxamide Formula: C23H36N2O3S MolecularWeight: 420.60854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(CC1)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC(C)(C)C1CCC(CC1)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C23H36N2O3S/c1-23(2,3)19-13-11-18(12-14-19)22(26)24-20-9-8-10-21(17-20)29(27,28)25-15-6-4-5-7-16-25/h8-10,17-19H,4-7,11-16H2,1-3H3,(H,24,26)