6-[[4-(azepan-1-ylsulfonyl)phenyl]hydrazinylidene]-4-bromanyl-2-methyl-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[4-(azepan-1-ylsulfonyl)phenyl]hydrazinylidene]-4-bromanyl-2-methyl-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[4-(azepan-1-ylsulfonyl)phenyl]hydrazono]-4-bromo-2-methyl-cyclohexa-2,4-dien-1-one CAS Name: 6-[[4-(1-azepanylsulfonyl)phenyl]hydrazinylidene]-4-bromo-2-methyl-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[4-(azepan-1-ylsulfonyl)phenyl]hydrazinylidene]-4-bromo-2-methylcyclohexa-2,4-dien-1-one Traditional Name: 6-[[4-(azepan-1-ylsulfonyl)phenyl]hydrazono]-4-bromo-2-methyl-cyclohexa-2,4-dien-1-one Formula: C19H22BrN3O3S MolecularWeight: 452.36528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=NNC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3)C1=O)Br

Isomeric SMILES

CC1=CC(=CC(=NNC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3)C1=O)Br

InChI

InChI=1S/C19H22BrN3O3S/c1-14-12-15(20)13-18(19(14)24)22-21-16-6-8-17(9-7-16)27(25,26)23-10-4-2-3-5-11-23/h6-9,12-13,21H,2-5,10-11H2,1H3