1-propan-2-yl-2-[(2S)-1-thiophen-2-ylcarbonylpyrrolidin-2-yl]benzimidazole-5-carboxylate

Systemtic Name: 1-propan-2-yl-2-[(2S)-1-thiophen-2-ylcarbonylpyrrolidin-2-yl]benzimidazole-5-carboxylate Openeye Name: 1-isopropyl-2-[(2S)-1-(thiophene-2-carbonyl)pyrrolidin-2-yl]benzimidazole-5-carboxylate CAS Name: 2-[(2S)-1-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinyl]-1-propan-2-yl-5-benzimidazolecarboxylate IUPAC Name: 1-propan-2-yl-2-[(2S)-1-(thiophene-2-carbonyl)pyrrolidin-2-yl]benzimidazole-5-carboxylate Traditional Name: 1-isopropyl-2-[(2S)-1-(2-thenoyl)pyrrolidin-2-yl]benzimidazole-5-carboxylate Formula: C20H20N3O3S- MolecularWeight: 382.4561

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C=C(C=C2)C(=O)[O-])N=C1C3CCCN3C(=O)C4=CC=CS4

Isomeric SMILES

CC(C)N1C2=C(C=C(C=C2)C(=O)[O-])N=C1[C@@H]3CCCN3C(=O)C4=CC=CS4

InChI

InChI=1S/C20H21N3O3S/c1-12(2)23-15-8-7-13(20(25)26)11-14(15)21-18(23)16-5-3-9-22(16)19(24)17-6-4-10-27-17/h4,6-8,10-12,16H,3,5,9H2,1-2H3,(H,25,26)/p-1/t16-/m0/s1