[(1R)-2-[(2,6-diethylphenyl)carbamothioylamino]-1-thiophen-2-yl-ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-2-[(2,6-diethylphenyl)carbamothioylamino]-1-thiophen-2-yl-ethyl]-dimethyl-azanium Openeye Name: [(1R)-2-[(2,6-diethylphenyl)carbamothioylamino]-1-(2-thienyl)ethyl]-dimethyl-ammonium CAS Name: [(1R)-2-[[(2,6-diethylanilino)-sulfanylidenemethyl]amino]-1-thiophen-2-ylethyl]-dimethylammonium IUPAC Name: [(1R)-2-[(2,6-diethylphenyl)carbamothioylamino]-1-thiophen-2-ylethyl]-dimethylazanium Traditional Name: [(1R)-2-[(2,6-diethylphenyl)thiocarbamoylamino]-1-(2-thienyl)ethyl]-dimethyl-ammonium Formula: C19H28N3S2+ MolecularWeight: 362.57572

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=S)NCC(C2=CC=CS2)[NH+](C)C

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=S)NC[C@H](C2=CC=CS2)[NH+](C)C

InChI

InChI=1S/C19H27N3S2/c1-5-14-9-7-10-15(6-2)18(14)21-19(23)20-13-16(22(3)4)17-11-8-12-24-17/h7-12,16H,5-6,13H2,1-4H3,(H2,20,21,23)/p+1/t16-/m1/s1