3-[(2,4-dichlorophenyl)carbamothioyl-(phenylmethyl)amino]propyl-dimethyl-azanium

Systemtic Name: 3-[(2,4-dichlorophenyl)carbamothioyl-(phenylmethyl)amino]propyl-dimethyl-azanium Openeye Name: 3-[benzyl-[(2,4-dichlorophenyl)carbamothioyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[(2,4-dichloroanilino)-sulfanylidenemethyl]-(phenylmethyl)amino]propyl-dimethylammonium IUPAC Name: 3-[benzyl-[(2,4-dichlorophenyl)carbamothioyl]amino]propyl-dimethylazanium Traditional Name: 3-[benzyl-[(2,4-dichlorophenyl)thiocarbamoyl]amino]propyl-dimethyl-ammonium Formula: C19H24Cl2N3S+ MolecularWeight: 397.38496

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCN(CC1=CC=CC=C1)C(=S)NC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

C[NH+](C)CCCN(CC1=CC=CC=C1)C(=S)NC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C19H23Cl2N3S/c1-23(2)11-6-12-24(14-15-7-4-3-5-8-15)19(25)22-18-10-9-16(20)13-17(18)21/h3-5,7-10,13H,6,11-12,14H2,1-2H3,(H,22,25)/p+1