3-(azepan-1-ylsulfonyl)-N-(2-dimethylaminoethyl)-2,6-bis(fluoranyl)benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-(2-dimethylaminoethyl)-2,6-bis(fluoranyl)benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-(2-dimethylaminoethyl)-2,6-difluoro-benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-(2-dimethylaminoethyl)-2,6-difluorobenzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-(2-dimethylaminoethyl)-2,6-difluorobenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-(2-dimethylaminoethyl)-2,6-difluoro-benzamide Formula: C17H25F2N3O3S MolecularWeight: 389.460506

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=O)C1=C(C=CC(=C1F)S(=O)(=O)N2CCCCCC2)F

Isomeric SMILES

CN(C)CCNC(=O)C1=C(C=CC(=C1F)S(=O)(=O)N2CCCCCC2)F

InChI

InChI=1S/C17H25F2N3O3S/c1-21(2)12-9-20-17(23)15-13(18)7-8-14(16(15)19)26(24,25)22-10-5-3-4-6-11-22/h7-8H,3-6,9-12H2,1-2H3,(H,20,23)