[(1S)-2-[(3-methoxyphenyl)carbamothioylamino]-1-thiophen-2-yl-ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-[(3-methoxyphenyl)carbamothioylamino]-1-thiophen-2-yl-ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[(3-methoxyphenyl)carbamothioylamino]-1-(2-thienyl)ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[[(3-methoxyanilino)-sulfanylidenemethyl]amino]-1-thiophen-2-ylethyl]-dimethylammonium IUPAC Name: [(1S)-2-[(3-methoxyphenyl)carbamothioylamino]-1-thiophen-2-ylethyl]-dimethylazanium Traditional Name: [(1S)-2-[(3-methoxyphenyl)thiocarbamoylamino]-1-(2-thienyl)ethyl]-dimethyl-ammonium Formula: C16H22N3OS2+ MolecularWeight: 336.49538

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=S)NC1=CC(=CC=C1)OC)C2=CC=CS2

Isomeric SMILES

C[NH+](C)[C@@H](CNC(=S)NC1=CC(=CC=C1)OC)C2=CC=CS2

InChI

InChI=1S/C16H21N3OS2/c1-19(2)14(15-8-5-9-22-15)11-17-16(21)18-12-6-4-7-13(10-12)20-3/h4-10,14H,11H2,1-3H3,(H2,17,18,21)/p+1/t14-/m0/s1