3-[[(5-bromanyl-2-methoxy-phenyl)methyl-methyl-carbamothioyl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[(5-bromanyl-2-methoxy-phenyl)methyl-methyl-carbamothioyl]amino]propyl-dimethyl-azanium Openeye Name: 3-[[(5-bromo-2-methoxy-phenyl)methyl-methyl-carbamothioyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[[(5-bromo-2-methoxyphenyl)methyl-methylamino]-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[(5-bromo-2-methoxyphenyl)methyl-methylcarbamothioyl]amino]propyl-dimethylazanium Traditional Name: 3-[[(5-bromo-2-methoxy-benzyl)-methyl-thiocarbamoyl]amino]propyl-dimethyl-ammonium Formula: C15H25BrN3OS+ MolecularWeight: 375.3475

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=S)N(C)CC1=C(C=CC(=C1)Br)OC

Isomeric SMILES

C[NH+](C)CCCNC(=S)N(C)CC1=C(C=CC(=C1)Br)OC

InChI

InChI=1S/C15H24BrN3OS/c1-18(2)9-5-8-17-15(21)19(3)11-12-10-13(16)6-7-14(12)20-4/h6-7,10H,5,8-9,11H2,1-4H3,(H,17,21)/p+1