4-(azepan-1-ylsulfonyl)-N-[[(2R)-1-ethylpyrrolidin-2-yl]methyl]benzamide

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N-[[(2R)-1-ethylpyrrolidin-2-yl]methyl]benzamide Openeye Name: 4-(azepan-1-ylsulfonyl)-N-[[(2R)-1-ethylpyrrolidin-2-yl]methyl]benzamide CAS Name: 4-(1-azepanylsulfonyl)-N-[[(2R)-1-ethyl-2-pyrrolidinyl]methyl]benzamide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N-[[(2R)-1-ethylpyrrolidin-2-yl]methyl]benzamide Traditional Name: 4-(azepan-1-ylsulfonyl)-N-[[(2R)-1-ethylpyrrolidin-2-yl]methyl]benzamide Formula: C20H31N3O3S MolecularWeight: 393.54344

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC1CNC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CCN1CCC[C@@H]1CNC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C20H31N3O3S/c1-2-22-13-7-8-18(22)16-21-20(24)17-9-11-19(12-10-17)27(25,26)23-14-5-3-4-6-15-23/h9-12,18H,2-8,13-16H2,1H3,(H,21,24)/t18-/m1/s1