dimethyl-[3-[(4-propan-2-yloxycarbonylphenyl)carbamothioylamino]propyl]azanium

Systemtic Name: dimethyl-[3-[(4-propan-2-yloxycarbonylphenyl)carbamothioylamino]propyl]azanium Openeye Name: 3-[(4-isopropoxycarbonylphenyl)carbamothioylamino]propyl-dimethyl-ammonium CAS Name: dimethyl-[3-[[[4-[oxo(propan-2-yloxy)methyl]anilino]-sulfanylidenemethyl]amino]propyl]ammonium IUPAC Name: dimethyl-[3-[(4-propan-2-yloxycarbonylphenyl)carbamothioylamino]propyl]azanium Traditional Name: 3-[(4-isopropoxycarbonylphenyl)thiocarbamoylamino]propyl-dimethyl-ammonium Formula: C16H26N3O2S+ MolecularWeight: 324.46154

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC=C(C=C1)NC(=S)NCCC[NH+](C)C

Isomeric SMILES

CC(C)OC(=O)C1=CC=C(C=C1)NC(=S)NCCC[NH+](C)C

InChI

InChI=1S/C16H25N3O2S/c1-12(2)21-15(20)13-6-8-14(9-7-13)18-16(22)17-10-5-11-19(3)4/h6-9,12H,5,10-11H2,1-4H3,(H2,17,18,22)/p+1