[(diphenylcarbamothioylamino)-phenyl-methylidene]-[(4-nitrophenyl)methyl]azanium

Systemtic Name: [(diphenylcarbamothioylamino)-phenyl-methylidene]-[(4-nitrophenyl)methyl]azanium Openeye Name: [(diphenylcarbamothioylamino)-phenyl-methylene]-[(4-nitrophenyl)methyl]ammonium CAS Name: (4-nitrophenyl)methyl-[phenyl-[[(N-phenylanilino)-sulfanylidenemethyl]amino]methylidene]ammonium IUPAC Name: [(diphenylcarbamothioylamino)-phenylmethylidene]-[(4-nitrophenyl)methyl]azanium Traditional Name: [(diphenylthiocarbamoylamino)-phenyl-methylene]-(4-nitrobenzyl)ammonium Formula: C27H23N4O2S+ MolecularWeight: 467.56212

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=[NH+]CC2=CC=C(C=C2)[N+](=O)[O-])NC(=S)N(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(=[NH+]CC2=CC=C(C=C2)[N+](=O)[O-])NC(=S)N(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H22N4O2S/c32-31(33)25-18-16-21(17-19-25)20-28-26(22-10-4-1-5-11-22)29-27(34)30(23-12-6-2-7-13-23)24-14-8-3-9-15-24/h1-19H,20H2,(H,28,29,34)/p+1