4-bromanyl-1-methyl-N'-(4-phenylsulfanylbutanoyl)pyrrole-2-carbohydrazide

Systemtic Name: 4-bromanyl-1-methyl-N'-(4-phenylsulfanylbutanoyl)pyrrole-2-carbohydrazide Openeye Name: 4-bromo-1-methyl-N'-(4-phenylsulfanylbutanoyl)pyrrole-2-carbohydrazide CAS Name: 4-bromo-1-methyl-N'-[1-oxo-4-(phenylthio)butyl]-2-pyrrolecarbohydrazide IUPAC Name: 4-bromo-1-methyl-N'-(4-phenylsulfanylbutanoyl)pyrrole-2-carbohydrazide Traditional Name: 4-bromo-1-methyl-N'-[4-(phenylthio)butanoyl]pyrrole-2-carbohydrazide Formula: C16H18BrN3O2S MolecularWeight: 396.30202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NNC(=O)CCCSC2=CC=CC=C2)Br

Isomeric SMILES

CN1C=C(C=C1C(=O)NNC(=O)CCCSC2=CC=CC=C2)Br

InChI

InChI=1S/C16H18BrN3O2S/c1-20-11-12(17)10-14(20)16(22)19-18-15(21)8-5-9-23-13-6-3-2-4-7-13/h2-4,6-7,10-11H,5,8-9H2,1H3,(H,18,21)(H,19,22)