methyl 6-[2-(1H-indol-3-yl)ethylamino]-5-morpholin-4-ylsulfonyl-pyridine-3-carboxylate

Systemtic Name: methyl 6-[2-(1H-indol-3-yl)ethylamino]-5-morpholin-4-ylsulfonyl-pyridine-3-carboxylate Openeye Name: methyl 6-[2-(1H-indol-3-yl)ethylamino]-5-morpholinosulfonyl-pyridine-3-carboxylate CAS Name: 6-[2-(1H-indol-3-yl)ethylamino]-5-(4-morpholinylsulfonyl)-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-[2-(1H-indol-3-yl)ethylamino]-5-morpholin-4-ylsulfonylpyridine-3-carboxylate Traditional Name: 6-[2-(1H-indol-3-yl)ethylamino]-5-morpholinosulfonyl-nicotinic acid methyl ester Formula: C21H24N4O5S MolecularWeight: 444.50406

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(N=C1)NCCC2=CNC3=CC=CC=C32)S(=O)(=O)N4CCOCC4

Isomeric SMILES

COC(=O)C1=CC(=C(N=C1)NCCC2=CNC3=CC=CC=C32)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H24N4O5S/c1-29-21(26)16-12-19(31(27,28)25-8-10-30-11-9-25)20(24-14-16)22-7-6-15-13-23-18-5-3-2-4-17(15)18/h2-5,12-14,23H,6-11H2,1H3,(H,22,24)