1-[(4-nitrophenyl)methyl]-N,5-diphenyl-2,3-dihydropyrrole-4-carbothioamide

Systemtic Name: 1-[(4-nitrophenyl)methyl]-N,5-diphenyl-2,3-dihydropyrrole-4-carbothioamide Openeye Name: 1-[(4-nitrophenyl)methyl]-N,5-diphenyl-2,3-dihydropyrrole-4-carbothioamide CAS Name: 1-[(4-nitrophenyl)methyl]-N,5-diphenyl-2,3-dihydropyrrole-4-carbothioamide IUPAC Name: 1-[(4-nitrophenyl)methyl]-N,5-diphenyl-2,3-dihydropyrrole-4-carbothioamide Traditional Name: 1-(4-nitrobenzyl)-N,2-diphenyl-2-pyrroline-3-carbothioamide Formula: C24H21N3O2S MolecularWeight: 415.50744

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=C1C(=S)NC2=CC=CC=C2)C3=CC=CC=C3)CC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(C(=C1C(=S)NC2=CC=CC=C2)C3=CC=CC=C3)CC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H21N3O2S/c28-27(29)21-13-11-18(12-14-21)17-26-16-15-22(23(26)19-7-3-1-4-8-19)24(30)25-20-9-5-2-6-10-20/h1-14H,15-17H2,(H,25,30)