2-[(4-benzamido-2,5-dimethoxy-phenyl)carbamothioylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(4-benzamido-2,5-dimethoxy-phenyl)carbamothioylamino]ethyl-dimethyl-azanium Openeye Name: 2-[(4-benzamido-2,5-dimethoxy-phenyl)carbamothioylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[(4-benzamido-2,5-dimethoxyanilino)-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(4-benzamido-2,5-dimethoxyphenyl)carbamothioylamino]ethyl-dimethylazanium Traditional Name: 2-[(4-benzamido-2,5-dimethoxy-phenyl)thiocarbamoylamino]ethyl-dimethyl-ammonium Formula: C20H27N4O3S+ MolecularWeight: 403.51838

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=S)NC1=C(C=C(C(=C1)OC)NC(=O)C2=CC=CC=C2)OC

Isomeric SMILES

C[NH+](C)CCNC(=S)NC1=C(C=C(C(=C1)OC)NC(=O)C2=CC=CC=C2)OC

InChI

InChI=1S/C20H26N4O3S/c1-24(2)11-10-21-20(28)23-16-13-17(26-3)15(12-18(16)27-4)22-19(25)14-8-6-5-7-9-14/h5-9,12-13H,10-11H2,1-4H3,(H,22,25)(H2,21,23,28)/p+1