4-bromanyl-N'-[2-(4-ethoxyphenyl)sulfanylethanoyl]-1H-pyrrole-2-carbohydrazide

Systemtic Name: 4-bromanyl-N'-[2-(4-ethoxyphenyl)sulfanylethanoyl]-1H-pyrrole-2-carbohydrazide Openeye Name: 4-bromo-N'-[2-(4-ethoxyphenyl)sulfanylacetyl]-1H-pyrrole-2-carbohydrazide CAS Name: 4-bromo-N'-[2-[(4-ethoxyphenyl)thio]-1-oxoethyl]-1H-pyrrole-2-carbohydrazide IUPAC Name: 4-bromo-N'-[2-(4-ethoxyphenyl)sulfanylacetyl]-1H-pyrrole-2-carbohydrazide Traditional Name: 4-bromo-N'-[2-(p-phenetylthio)acetyl]-1H-pyrrole-2-carbohydrazide Formula: C15H16BrN3O3S MolecularWeight: 398.27484

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)SCC(=O)NNC(=O)C2=CC(=CN2)Br

Isomeric SMILES

CCOC1=CC=C(C=C1)SCC(=O)NNC(=O)C2=CC(=CN2)Br

InChI

InChI=1S/C15H16BrN3O3S/c1-2-22-11-3-5-12(6-4-11)23-9-14(20)18-19-15(21)13-7-10(16)8-17-13/h3-8,17H,2,9H2,1H3,(H,18,20)(H,19,21)