ethyl 1,2,5-trimethyl-4-[4-[(5-methylpyridin-2-yl)carbamoyl]piperidin-1-yl]sulfonyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 1,2,5-trimethyl-4-[4-[(5-methylpyridin-2-yl)carbamoyl]piperidin-1-yl]sulfonyl-pyrrole-3-carboxylate Openeye Name: ethyl 1,2,5-trimethyl-4-[[4-[(5-methyl-2-pyridyl)carbamoyl]-1-piperidyl]sulfonyl]pyrrole-3-carboxylate CAS Name: 1,2,5-trimethyl-4-[[4-[[(5-methyl-2-pyridinyl)amino]-oxomethyl]-1-piperidinyl]sulfonyl]-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1,2,5-trimethyl-4-[4-[(5-methylpyridin-2-yl)carbamoyl]piperidin-1-yl]sulfonylpyrrole-3-carboxylate Traditional Name: 1,2,5-trimethyl-4-[4-[(5-methyl-2-pyridyl)carbamoyl]piperidino]sulfonyl-pyrrole-3-carboxylic acid ethyl ester Formula: C22H30N4O5S MolecularWeight: 462.5624

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1S(=O)(=O)N2CCC(CC2)C(=O)NC3=NC=C(C=C3)C)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1S(=O)(=O)N2CCC(CC2)C(=O)NC3=NC=C(C=C3)C)C)C)C

InChI

InChI=1S/C22H30N4O5S/c1-6-31-22(28)19-15(3)25(5)16(4)20(19)32(29,30)26-11-9-17(10-12-26)21(27)24-18-8-7-14(2)13-23-18/h7-8,13,17H,6,9-12H2,1-5H3,(H,23,24,27)