2,5-dimethyl-N'-[2-(4-nitrophenyl)sulfanylethanoyl]-1-phenyl-pyrrole-3-carbohydrazide

Systemtic Name: 2,5-dimethyl-N'-[2-(4-nitrophenyl)sulfanylethanoyl]-1-phenyl-pyrrole-3-carbohydrazide Openeye Name: 2,5-dimethyl-N'-[2-(4-nitrophenyl)sulfanylacetyl]-1-phenyl-pyrrole-3-carbohydrazide CAS Name: 2,5-dimethyl-N'-[2-[(4-nitrophenyl)thio]-1-oxoethyl]-1-phenyl-3-pyrrolecarbohydrazide IUPAC Name: 2,5-dimethyl-N'-[2-(4-nitrophenyl)sulfanylacetyl]-1-phenylpyrrole-3-carbohydrazide Traditional Name: 2,5-dimethyl-N'-[2-[(4-nitrophenyl)thio]acetyl]-1-phenyl-pyrrole-3-carbohydrazide Formula: C21H20N4O4S MolecularWeight: 424.4729

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC=C2)C)C(=O)NNC(=O)CSC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(N1C2=CC=CC=C2)C)C(=O)NNC(=O)CSC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H20N4O4S/c1-14-12-19(15(2)24(14)16-6-4-3-5-7-16)21(27)23-22-20(26)13-30-18-10-8-17(9-11-18)25(28)29/h3-12H,13H2,1-2H3,(H,22,26)(H,23,27)