2-[2-[2-(4-bromanyl-1-methyl-pyrrol-2-yl)carbonylhydrazinyl]-2-oxidanylidene-ethyl]sulfanyl-N-(4-methylphenyl)ethanamide

Systemtic Name: 2-[2-[2-(4-bromanyl-1-methyl-pyrrol-2-yl)carbonylhydrazinyl]-2-oxidanylidene-ethyl]sulfanyl-N-(4-methylphenyl)ethanamide Openeye Name: 2-[2-[2-(4-bromo-1-methyl-pyrrole-2-carbonyl)hydrazino]-2-oxo-ethyl]sulfanyl-N-(p-tolyl)acetamide CAS Name: 2-[[2-[[(4-bromo-1-methyl-2-pyrrolyl)-oxomethyl]hydrazo]-2-oxoethyl]thio]-N-(4-methylphenyl)acetamide IUPAC Name: 2-[2-[2-(4-bromo-1-methylpyrrole-2-carbonyl)hydrazinyl]-2-oxoethyl]sulfanyl-N-(4-methylphenyl)acetamide Traditional Name: 2-[[2-[N'-(4-bromo-1-methyl-pyrrole-2-carbonyl)hydrazino]-2-keto-ethyl]thio]-N-(p-tolyl)acetamide Formula: C17H19BrN4O3S MolecularWeight: 439.32676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSCC(=O)NNC(=O)C2=CC(=CN2C)Br

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSCC(=O)NNC(=O)C2=CC(=CN2C)Br

InChI

InChI=1S/C17H19BrN4O3S/c1-11-3-5-13(6-4-11)19-15(23)9-26-10-16(24)20-21-17(25)14-7-12(18)8-22(14)2/h3-8H,9-10H2,1-2H3,(H,19,23)(H,20,24)(H,21,25)