pentanoyl 2-azanyl-4-ethyl-5-(1H-imidazol-5-yl)-5-methyl-1-[(3-pyridin-2-ylphenyl)sulfonylamino]piperidine-2-carboxylate

Systemtic Name: pentanoyl 2-azanyl-4-ethyl-5-(1H-imidazol-5-yl)-5-methyl-1-[(3-pyridin-2-ylphenyl)sulfonylamino]piperidine-2-carboxylate Openeye Name: pentanoyl 2-amino-4-ethyl-5-(1H-imidazol-5-yl)-5-methyl-1-[[3-(2-pyridyl)phenyl]sulfonylamino]piperidine-2-carboxylate CAS Name: 2-amino-4-ethyl-5-(1H-imidazol-5-yl)-5-methyl-1-[[3-(2-pyridinyl)phenyl]sulfonylamino]-2-piperidinecarboxylic acid 1-oxopentyl ester IUPAC Name: pentanoyl 2-amino-4-ethyl-5-(1H-imidazol-5-yl)-5-methyl-1-[(3-pyridin-2-ylphenyl)sulfonylamino]piperidine-2-carboxylate Traditional Name: 2-amino-4-ethyl-5-(1H-imidazol-5-yl)-5-methyl-1-[[3-(2-pyridyl)phenyl]sulfonylamino]pipecolinic acid valeryl ester Formula: C28H36N6O5S MolecularWeight: 568.68764

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OC(=O)C1(CC(C(CN1NS(=O)(=O)C2=CC=CC(=C2)C3=CC=CC=N3)(C)C4=CN=CN4)CC)N

Isomeric SMILES

CCCCC(=O)OC(=O)C1(CC(C(CN1NS(=O)(=O)C2=CC=CC(=C2)C3=CC=CC=N3)(C)C4=CN=CN4)CC)N

InChI

InChI=1S/C28H36N6O5S/c1-4-6-13-25(35)39-26(36)28(29)16-21(5-2)27(3,24-17-30-19-32-24)18-34(28)33-40(37,38)22-11-9-10-20(15-22)23-12-7-8-14-31-23/h7-12,14-15,17,19,21,33H,4-6,13,16,18,29H2,1-3H3,(H,30,32)