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ethyl 4-[2-(1H-benzimidazol-2-ylsulfanyl)ethanoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-[2-(1H-benzimidazol-2-ylsulfanyl)ethanoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
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Descriptors Computed from Structure
Canonical SMILES:
CCOC(=O)C1=C(C(=C(N1)C)C(=O)CSC2=NC3=CC=CC=C3N2)C
Isomeric SMILES
CCOC(=O)C1=C(C(=C(N1)C)C(=O)CSC2=NC3=CC=CC=C3N2)C
InChI
InChI=1S/C18H19N3O3S/c1-4-24-17(23)16-10(2)15(11(3)19-16)14(22)9-25-18-20-12-7-5-6-8-13(12)21-18/h5-8,19H,4,9H2,1-3H3,(H,20,21)
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