[(1R)-2-[(4-ethoxycarbonylphenyl)carbamothioylamino]-1-thiophen-2-yl-ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-2-[(4-ethoxycarbonylphenyl)carbamothioylamino]-1-thiophen-2-yl-ethyl]-dimethyl-azanium Openeye Name: [(1R)-2-[(4-ethoxycarbonylphenyl)carbamothioylamino]-1-(2-thienyl)ethyl]-dimethyl-ammonium CAS Name: [(1R)-2-[[(4-ethoxycarbonylanilino)-sulfanylidenemethyl]amino]-1-thiophen-2-ylethyl]-dimethylammonium IUPAC Name: [(1R)-2-[(4-ethoxycarbonylphenyl)carbamothioylamino]-1-thiophen-2-ylethyl]-dimethylazanium Traditional Name: [(1R)-2-[(4-carbethoxyphenyl)thiocarbamoylamino]-1-(2-thienyl)ethyl]-dimethyl-ammonium Formula: C18H24N3O2S2+ MolecularWeight: 378.53206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23N3O2S2/c1-4-23-17(22)13-7-9-14(10-8-13)20-18(24)19-12-15(21(2)3)16-6-5-11-25-16/h5-11,15H,4,12H2,1-3H3,(H2,19,20,24)/p+1/t15-/m1/s1