2-[4-(5-bromanylthiophen-2-yl)sulfonyl-1,4-diazepan-1-yl]-N-(3-chloranyl-4-fluoranyl-phenyl)ethanamide

Systemtic Name: 2-[4-(5-bromanylthiophen-2-yl)sulfonyl-1,4-diazepan-1-yl]-N-(3-chloranyl-4-fluoranyl-phenyl)ethanamide Openeye Name: 2-[4-[(5-bromo-2-thienyl)sulfonyl]-1,4-diazepan-1-yl]-N-(3-chloro-4-fluoro-phenyl)acetamide CAS Name: 2-[4-[(5-bromo-2-thiophenyl)sulfonyl]-1,4-diazepan-1-yl]-N-(3-chloro-4-fluorophenyl)acetamide IUPAC Name: 2-[4-(5-bromothiophen-2-yl)sulfonyl-1,4-diazepan-1-yl]-N-(3-chloro-4-fluorophenyl)acetamide Traditional Name: 2-[4-[(5-bromo-2-thienyl)sulfonyl]-1,4-diazepan-1-yl]-N-(3-chloro-4-fluoro-phenyl)acetamide Formula: C17H18BrClFN3O3S2 MolecularWeight: 510.828523

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)S(=O)(=O)C2=CC=C(S2)Br)CC(=O)NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1CN(CCN(C1)S(=O)(=O)C2=CC=C(S2)Br)CC(=O)NC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C17H18BrClFN3O3S2/c18-15-4-5-17(27-15)28(25,26)23-7-1-6-22(8-9-23)11-16(24)21-12-2-3-14(20)13(19)10-12/h2-5,10H,1,6-9,11H2,(H,21,24)