N-[(4S)-5-azanyl-4-[bis(chloranyl)methyl]-2-phenyl-imidazole-1,3-diium-4-yl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(4S)-5-azanyl-4-[bis(chloranyl)methyl]-2-phenyl-imidazole-1,3-diium-4-yl]-4-methyl-benzenesulfonamide Openeye Name: N-[(4S)-5-amino-4-(dichloromethyl)-2-phenyl-imidazole-1,3-diium-4-yl]-4-methyl-benzenesulfonamide CAS Name: N-[(4S)-5-amino-4-(dichloromethyl)-2-phenyl-4-imidazole-1,3-diiumyl]-4-methylbenzenesulfonamide IUPAC Name: N-[(4S)-5-amino-4-(dichloromethyl)-2-phenylimidazole-1,3-diium-4-yl]-4-methylbenzenesulfonamide Traditional Name: N-[(4S)-5-amino-4-(dichloromethyl)-2-phenyl-imidazole-1,3-diium-4-yl]-4-methyl-benzenesulfonamide Formula: C17H18Cl2N4O2S+2 MolecularWeight: 413.32142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2(C(=[NH+]C(=[NH+]2)C3=CC=CC=C3)N)C(Cl)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@]2(C(=[NH+]C(=[NH+]2)C3=CC=CC=C3)N)C(Cl)Cl

InChI

InChI=1S/C17H16Cl2N4O2S/c1-11-7-9-13(10-8-11)26(24,25)23-17(15(18)19)16(20)21-14(22-17)12-5-3-2-4-6-12/h2-10,15,23H,1H3,(H2,20,21,22)/p+2/t17-/m1/s1