N-(2,5-dimethylphenyl)-3-(phenylmethyl)imidazolidin-3-ium-1-carbothioamide

Systemtic Name: N-(2,5-dimethylphenyl)-3-(phenylmethyl)imidazolidin-3-ium-1-carbothioamide Openeye Name: 3-benzyl-N-(2,5-dimethylphenyl)imidazolidin-3-ium-1-carbothioamide CAS Name: N-(2,5-dimethylphenyl)-3-(phenylmethyl)-1-imidazolidin-3-iumcarbothioamide IUPAC Name: 3-benzyl-N-(2,5-dimethylphenyl)imidazolidin-3-ium-1-carbothioamide Traditional Name: 3-benzyl-N-(2,5-dimethylphenyl)imidazolidin-3-ium-1-carbothioamide Formula: C19H24N3S+ MolecularWeight: 326.47896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=S)N2CC[NH+](C2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=S)N2CC[NH+](C2)CC3=CC=CC=C3

InChI

InChI=1S/C19H23N3S/c1-15-8-9-16(2)18(12-15)20-19(23)22-11-10-21(14-22)13-17-6-4-3-5-7-17/h3-9,12H,10-11,13-14H2,1-2H3,(H,20,23)/p+1