4-(3-chloranyl-4-fluoranyl-phenyl)sulfonyl-N-[(2-chlorophenyl)methyl]-1,4-diazepane-1-carboxamide

Systemtic Name: 4-(3-chloranyl-4-fluoranyl-phenyl)sulfonyl-N-[(2-chlorophenyl)methyl]-1,4-diazepane-1-carboxamide Openeye Name: 4-(3-chloro-4-fluoro-phenyl)sulfonyl-N-[(2-chlorophenyl)methyl]-1,4-diazepane-1-carboxamide CAS Name: 4-(3-chloro-4-fluorophenyl)sulfonyl-N-[(2-chlorophenyl)methyl]-1,4-diazepane-1-carboxamide IUPAC Name: 4-(3-chloro-4-fluorophenyl)sulfonyl-N-[(2-chlorophenyl)methyl]-1,4-diazepane-1-carboxamide Traditional Name: N-(2-chlorobenzyl)-4-(3-chloro-4-fluoro-phenyl)sulfonyl-1,4-diazepane-1-carboxamide Formula: C19H20Cl2FN3O3S MolecularWeight: 460.349803

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)F)Cl)C(=O)NCC3=CC=CC=C3Cl

Isomeric SMILES

C1CN(CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)F)Cl)C(=O)NCC3=CC=CC=C3Cl

InChI

InChI=1S/C19H20Cl2FN3O3S/c20-16-5-2-1-4-14(16)13-23-19(26)24-8-3-9-25(11-10-24)29(27,28)15-6-7-18(22)17(21)12-15/h1-2,4-7,12H,3,8-11,13H2,(H,23,26)