3-[[(R)-(4-methoxyphenyl)-phenyl-methyl]carbamothioylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[[(R)-(4-methoxyphenyl)-phenyl-methyl]carbamothioylamino]propyl-dimethyl-azanium Openeye Name: 3-[[(R)-(4-methoxyphenyl)-phenyl-methyl]carbamothioylamino]propyl-dimethyl-ammonium CAS Name: 3-[[[[(R)-(4-methoxyphenyl)-phenylmethyl]amino]-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[(R)-(4-methoxyphenyl)-phenylmethyl]carbamothioylamino]propyl-dimethylazanium Traditional Name: 3-[[(R)-(4-methoxyphenyl)-phenyl-methyl]thiocarbamoylamino]propyl-dimethyl-ammonium Formula: C20H28N3OS+ MolecularWeight: 358.52082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=S)NC(C1=CC=CC=C1)C2=CC=C(C=C2)OC

Isomeric SMILES

C[NH+](C)CCCNC(=S)N[C@H](C1=CC=CC=C1)C2=CC=C(C=C2)OC

InChI

InChI=1S/C20H27N3OS/c1-23(2)15-7-14-21-20(25)22-19(16-8-5-4-6-9-16)17-10-12-18(24-3)13-11-17/h4-6,8-13,19H,7,14-15H2,1-3H3,(H2,21,22,25)/p+1/t19-/m1/s1