diethyl-[(1S)-2-[(4-methoxyphenyl)carbamothioylamino]-1-phenyl-ethyl]azanium

Systemtic Name: diethyl-[(1S)-2-[(4-methoxyphenyl)carbamothioylamino]-1-phenyl-ethyl]azanium Openeye Name: diethyl-[(1S)-2-[(4-methoxyphenyl)carbamothioylamino]-1-phenyl-ethyl]ammonium CAS Name: diethyl-[(1S)-2-[[(4-methoxyanilino)-sulfanylidenemethyl]amino]-1-phenylethyl]ammonium IUPAC Name: diethyl-[(1S)-2-[(4-methoxyphenyl)carbamothioylamino]-1-phenylethyl]azanium Traditional Name: diethyl-[(1S)-2-[(4-methoxyphenyl)thiocarbamoylamino]-1-phenyl-ethyl]ammonium Formula: C20H28N3OS+ MolecularWeight: 358.52082

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(CNC(=S)NC1=CC=C(C=C1)OC)C2=CC=CC=C2

Isomeric SMILES

CC[NH+](CC)[C@H](CNC(=S)NC1=CC=C(C=C1)OC)C2=CC=CC=C2

InChI

InChI=1S/C20H27N3OS/c1-4-23(5-2)19(16-9-7-6-8-10-16)15-21-20(25)22-17-11-13-18(24-3)14-12-17/h6-14,19H,4-5,15H2,1-3H3,(H2,21,22,25)/p+1/t19-/m1/s1