ethyl 2,5-dimethyl-4-[3-(propan-2-ylcarbamoyl)piperidin-1-yl]sulfonyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,5-dimethyl-4-[3-(propan-2-ylcarbamoyl)piperidin-1-yl]sulfonyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-[[3-(isopropylcarbamoyl)-1-piperidyl]sulfonyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-4-[[3-[oxo-(propan-2-ylamino)methyl]-1-piperidinyl]sulfonyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,5-dimethyl-4-[3-(propan-2-ylcarbamoyl)piperidin-1-yl]sulfonyl-1H-pyrrole-3-carboxylate Traditional Name: 4-[3-(isopropylcarbamoyl)piperidino]sulfonyl-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C18H29N3O5S MolecularWeight: 399.50496

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1S(=O)(=O)N2CCCC(C2)C(=O)NC(C)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1S(=O)(=O)N2CCCC(C2)C(=O)NC(C)C)C)C

InChI

InChI=1S/C18H29N3O5S/c1-6-26-18(23)15-12(4)20-13(5)16(15)27(24,25)21-9-7-8-14(10-21)17(22)19-11(2)3/h11,14,20H,6-10H2,1-5H3,(H,19,22)