ethyl 4-methyl-2-[3-(4-pyrrolidin-1-ylsulfonylphenyl)propanoylamino]-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-methyl-2-[3-(4-pyrrolidin-1-ylsulfonylphenyl)propanoylamino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-methyl-2-[3-(4-pyrrolidin-1-ylsulfonylphenyl)propanoylamino]thiazole-5-carboxylate CAS Name: 4-methyl-2-[[1-oxo-3-[4-(1-pyrrolidinylsulfonyl)phenyl]propyl]amino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[3-(4-pyrrolidin-1-ylsulfonylphenyl)propanoylamino]-1,3-thiazole-5-carboxylate Traditional Name: 4-methyl-2-[3-(4-pyrrolidinosulfonylphenyl)propanoylamino]thiazole-5-carboxylic acid ethyl ester Formula: C20H25N3O5S2 MolecularWeight: 451.5596

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCC3)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCC3)C

InChI

InChI=1S/C20H25N3O5S2/c1-3-28-19(25)18-14(2)21-20(29-18)22-17(24)11-8-15-6-9-16(10-7-15)30(26,27)23-12-4-5-13-23/h6-7,9-10H,3-5,8,11-13H2,1-2H3,(H,21,22,24)