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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CCCCC1CCC(CC1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C23H36N2O3S/c1-2-3-8-19-9-11-20(12-10-19)23(26)24-21-13-15-22(16-14-21)29(27,28)25-17-6-4-5-7-18-25/h13-16,19-20H,2-12,17-18H2,1H3,(H,24,26)