5-(azepan-1-ylsulfonyl)-2-chloranyl-N-(3-pyrrolidin-1-ylpropyl)benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-2-chloranyl-N-(3-pyrrolidin-1-ylpropyl)benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-2-chloro-N-(3-pyrrolidin-1-ylpropyl)benzamide CAS Name: 5-(1-azepanylsulfonyl)-2-chloro-N-[3-(1-pyrrolidinyl)propyl]benzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-2-chloro-N-(3-pyrrolidin-1-ylpropyl)benzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-2-chloro-N-(3-pyrrolidinopropyl)benzamide Formula: C20H30ClN3O3S MolecularWeight: 427.9885

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NCCCN3CCCC3

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NCCCN3CCCC3

InChI

InChI=1S/C20H30ClN3O3S/c21-19-9-8-17(28(26,27)24-14-3-1-2-4-15-24)16-18(19)20(25)22-10-7-13-23-11-5-6-12-23/h8-9,16H,1-7,10-15H2,(H,22,25)