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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1S(=O)(=O)N2CCCC(C2)C(=O)NC3=C(C=CC=N3)C)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1S(=O)(=O)N2CCCC(C2)C(=O)NC3=C(C=CC=N3)C)C)C)C

InChI

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