methyl 2,4-dimethyl-5-[2-(5-morpholin-4-ylsulfonylpyridin-2-yl)sulfanylethanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2,4-dimethyl-5-[2-(5-morpholin-4-ylsulfonylpyridin-2-yl)sulfanylethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 2,4-dimethyl-5-[2-[(5-morpholinosulfonyl-2-pyridyl)sulfanyl]acetyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[2-[[5-(4-morpholinylsulfonyl)-2-pyridinyl]thio]-1-oxoethyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2,4-dimethyl-5-[2-(5-morpholin-4-ylsulfonylpyridin-2-yl)sulfanylacetyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[2-[(5-morpholinosulfonyl-2-pyridyl)thio]acetyl]-1H-pyrrole-3-carboxylic acid methyl ester Formula: C19H23N3O6S2 MolecularWeight: 453.53242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)CSC2=NC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)CSC2=NC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C19H23N3O6S2/c1-12-17(19(24)27-3)13(2)21-18(12)15(23)11-29-16-5-4-14(10-20-16)30(25,26)22-6-8-28-9-7-22/h4-5,10,21H,6-9,11H2,1-3H3