diethyl-[[2-[[(4-propan-2-ylphenyl)carbamothioylamino]methyl]phenyl]methyl]azanium

Systemtic Name: diethyl-[[2-[[(4-propan-2-ylphenyl)carbamothioylamino]methyl]phenyl]methyl]azanium Openeye Name: diethyl-[[2-[[(4-isopropylphenyl)carbamothioylamino]methyl]phenyl]methyl]ammonium CAS Name: diethyl-[[2-[[[(4-propan-2-ylanilino)-sulfanylidenemethyl]amino]methyl]phenyl]methyl]ammonium IUPAC Name: diethyl-[[2-[[(4-propan-2-ylphenyl)carbamothioylamino]methyl]phenyl]methyl]azanium Traditional Name: diethyl-[2-[(p-cumenylthiocarbamoylamino)methyl]benzyl]ammonium Formula: C22H32N3S+ MolecularWeight: 370.57458

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=CC=CC=C1CNC(=S)NC2=CC=C(C=C2)C(C)C

Isomeric SMILES

CC[NH+](CC)CC1=CC=CC=C1CNC(=S)NC2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C22H31N3S/c1-5-25(6-2)16-20-10-8-7-9-19(20)15-23-22(26)24-21-13-11-18(12-14-21)17(3)4/h7-14,17H,5-6,15-16H2,1-4H3,(H2,23,24,26)/p+1