[[(diphenylamino)carbamothioylamino]-(4-methylphenyl)methylidene]-(phenylmethyl)azanium

Systemtic Name: [[(diphenylamino)carbamothioylamino]-(4-methylphenyl)methylidene]-(phenylmethyl)azanium Openeye Name: benzyl-[[(N-phenylanilino)carbamothioylamino]-(p-tolyl)methylene]ammonium CAS Name: [[[(2,2-diphenylhydrazinyl)-sulfanylidenemethyl]amino]-(4-methylphenyl)methylidene]-(phenylmethyl)ammonium IUPAC Name: benzyl-[(4-methylphenyl)-[(N-phenylanilino)carbamothioylamino]methylidene]azanium Traditional Name: benzyl-[[(N-phenylanilino)thiocarbamoylamino]-(p-tolyl)methylene]ammonium Formula: C28H27N4S+ MolecularWeight: 451.60578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=[NH+]CC2=CC=CC=C2)NC(=S)NN(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C(=[NH+]CC2=CC=CC=C2)NC(=S)NN(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H26N4S/c1-22-17-19-24(20-18-22)27(29-21-23-11-5-2-6-12-23)30-28(33)31-32(25-13-7-3-8-14-25)26-15-9-4-10-16-26/h2-20H,21H2,1H3,(H2,29,30,31,33)/p+1