methyl 6-[(5-piperidin-1-ylsulfonyl-2-propan-2-yloxy-phenyl)carbamoyl]pyridine-3-carboxylate

Systemtic Name: methyl 6-[(5-piperidin-1-ylsulfonyl-2-propan-2-yloxy-phenyl)carbamoyl]pyridine-3-carboxylate Openeye Name: methyl 6-[[2-isopropoxy-5-(1-piperidylsulfonyl)phenyl]carbamoyl]pyridine-3-carboxylate CAS Name: 6-[oxo-[5-(1-piperidinylsulfonyl)-2-propan-2-yloxyanilino]methyl]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-[(5-piperidin-1-ylsulfonyl-2-propan-2-yloxyphenyl)carbamoyl]pyridine-3-carboxylate Traditional Name: 6-[(2-isopropoxy-5-piperidinosulfonyl-phenyl)carbamoyl]nicotinic acid methyl ester Formula: C22H27N3O6S MolecularWeight: 461.53128

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=NC=C(C=C3)C(=O)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=NC=C(C=C3)C(=O)OC

InChI

InChI=1S/C22H27N3O6S/c1-15(2)31-20-10-8-17(32(28,29)25-11-5-4-6-12-25)13-19(20)24-21(26)18-9-7-16(14-23-18)22(27)30-3/h7-10,13-15H,4-6,11-12H2,1-3H3,(H,24,26)