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N-(2,3-dimethylphenyl)-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]ethanamide
N-(2,3-dimethylphenyl)-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]ethanamide
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Descriptors Computed from Structure
Canonical SMILES:
CC1=C(C(=CC=C1)NC(=O)CSC2=[N+](C3=CC=CC=C3N2)C)C
Isomeric SMILES
CC1=C(C(=CC=C1)NC(=O)CSC2=[N+](C3=CC=CC=C3N2)C)C
InChI
InChI=1S/C18H19N3OS/c1-12-7-6-9-14(13(12)2)19-17(22)11-23-18-20-15-8-4-5-10-16(15)21(18)3/h4-10H,11H2,1-3H3,(H,19,22)/p+1
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