[2-[[5-aminocarbonyl-3-(2-methoxyethoxycarbonyl)-4-methyl-thiophen-2-yl]amino]-2-oxidanylidene-ethyl] (2S)-1-methylsulfonylpyrrolidine-2-carboxylate

Systemtic Name: [2-[[5-aminocarbonyl-3-(2-methoxyethoxycarbonyl)-4-methyl-thiophen-2-yl]amino]-2-oxidanylidene-ethyl] (2S)-1-methylsulfonylpyrrolidine-2-carboxylate Openeye Name: [2-[[5-carbamoyl-3-(2-methoxyethoxycarbonyl)-4-methyl-2-thienyl]amino]-2-oxo-ethyl] (2S)-1-methylsulfonylpyrrolidine-2-carboxylate CAS Name: (2S)-1-methylsulfonyl-2-pyrrolidinecarboxylic acid [2-[[5-carbamoyl-3-[2-methoxyethoxy(oxo)methyl]-4-methyl-2-thiophenyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[5-carbamoyl-3-(2-methoxyethoxycarbonyl)-4-methylthiophen-2-yl]amino]-2-oxoethyl] (2S)-1-methylsulfonylpyrrolidine-2-carboxylate Traditional Name: (2S)-1-mesylpyrrolidine-2-carboxylic acid [2-[[5-carbamoyl-3-(2-methoxyethoxycarbonyl)-4-methyl-2-thienyl]amino]-2-keto-ethyl] ester Formula: C18H25N3O9S2 MolecularWeight: 491.5358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OCCOC)NC(=O)COC(=O)C2CCCN2S(=O)(=O)C)C(=O)N

Isomeric SMILES

CC1=C(SC(=C1C(=O)OCCOC)NC(=O)COC(=O)[C@@H]2CCCN2S(=O)(=O)C)C(=O)N

InChI

InChI=1S/C18H25N3O9S2/c1-10-13(18(25)29-8-7-28-2)16(31-14(10)15(19)23)20-12(22)9-30-17(24)11-5-4-6-21(11)32(3,26)27/h11H,4-9H2,1-3H3,(H2,19,23)(H,20,22)/t11-/m0/s1