1-(azepan-1-yl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)propan-1-one

Systemtic Name: 1-(azepan-1-yl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)propan-1-one Openeye Name: 1-(azepan-1-yl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)propan-1-one CAS Name: 1-(1-azepanyl)-3-[4-(1-pyrrolidinylsulfonyl)phenyl]-1-propanone IUPAC Name: 1-(azepan-1-yl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)propan-1-one Traditional Name: 1-(azepan-1-yl)-3-(4-pyrrolidinosulfonylphenyl)propan-1-one Formula: C19H28N2O3S MolecularWeight: 364.50222

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

C1CCCN(CC1)C(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C19H28N2O3S/c22-19(20-13-3-1-2-4-14-20)12-9-17-7-10-18(11-8-17)25(23,24)21-15-5-6-16-21/h7-8,10-11H,1-6,9,12-16H2