[[(4-methoxyphenyl)carbamothioylamino]-phenyl-methylidene]-(phenylsulfonylmethyl)azanium

Systemtic Name: [[(4-methoxyphenyl)carbamothioylamino]-phenyl-methylidene]-(phenylsulfonylmethyl)azanium Openeye Name: benzenesulfonylmethyl-[[(4-methoxyphenyl)carbamothioylamino]-phenyl-methylene]ammonium CAS Name: benzenesulfonylmethyl-[[[(4-methoxyanilino)-sulfanylidenemethyl]amino]-phenylmethylidene]ammonium IUPAC Name: benzenesulfonylmethyl-[[(4-methoxyphenyl)carbamothioylamino]-phenylmethylidene]azanium Traditional Name: besylmethyl-[[(4-methoxyphenyl)thiocarbamoylamino]-phenyl-methylene]ammonium Formula: C22H22N3O3S2+ MolecularWeight: 440.55838

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=S)NC(=[NH+]CS(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)NC(=S)NC(=[NH+]CS(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H21N3O3S2/c1-28-19-14-12-18(13-15-19)24-22(29)25-21(17-8-4-2-5-9-17)23-16-30(26,27)20-10-6-3-7-11-20/h2-15H,16H2,1H3,(H2,23,24,25,29)/p+1