methyl 2-ethyl-4-methyl-5-[(2-morpholin-4-ylsulfonylphenyl)methylcarbamoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2-ethyl-4-methyl-5-[(2-morpholin-4-ylsulfonylphenyl)methylcarbamoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 2-ethyl-4-methyl-5-[(2-morpholinosulfonylphenyl)methylcarbamoyl]-1H-pyrrole-3-carboxylate CAS Name: 2-ethyl-4-methyl-5-[[[2-(4-morpholinylsulfonyl)phenyl]methylamino]-oxomethyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2-ethyl-4-methyl-5-[(2-morpholin-4-ylsulfonylphenyl)methylcarbamoyl]-1H-pyrrole-3-carboxylate Traditional Name: 2-ethyl-4-methyl-5-[(2-morpholinosulfonylbenzyl)carbamoyl]-1H-pyrrole-3-carboxylic acid methyl ester Formula: C21H27N3O6S MolecularWeight: 449.52058

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(N1)C(=O)NCC2=CC=CC=C2S(=O)(=O)N3CCOCC3)C)C(=O)OC

Isomeric SMILES

CCC1=C(C(=C(N1)C(=O)NCC2=CC=CC=C2S(=O)(=O)N3CCOCC3)C)C(=O)OC

InChI

InChI=1S/C21H27N3O6S/c1-4-16-18(21(26)29-3)14(2)19(23-16)20(25)22-13-15-7-5-6-8-17(15)31(27,28)24-9-11-30-12-10-24/h5-8,23H,4,9-13H2,1-3H3,(H,22,25)