4-(azepan-1-ylsulfonyl)-N'-(4-bromophenyl)carbonyl-benzohydrazide

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N'-(4-bromophenyl)carbonyl-benzohydrazide Openeye Name: 4-(azepan-1-ylsulfonyl)-N'-(4-bromobenzoyl)benzohydrazide CAS Name: 4-(1-azepanylsulfonyl)-N'-[(4-bromophenyl)-oxomethyl]benzohydrazide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N'-(4-bromobenzoyl)benzohydrazide Traditional Name: 4-(azepan-1-ylsulfonyl)-N'-(4-bromobenzoyl)benzohydrazide Formula: C20H22BrN3O4S MolecularWeight: 480.37538

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NNC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NNC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H22BrN3O4S/c21-17-9-5-15(6-10-17)19(25)22-23-20(26)16-7-11-18(12-8-16)29(27,28)24-13-3-1-2-4-14-24/h5-12H,1-4,13-14H2,(H,22,25)(H,23,26)