1-methyl-2-oxidanyl-3-[(3R)-3-(pyridin-2-ylmethylamino)-3-thiophen-2-yl-propanoyl]quinolin-4-one

Systemtic Name: 1-methyl-2-oxidanyl-3-[(3R)-3-(pyridin-2-ylmethylamino)-3-thiophen-2-yl-propanoyl]quinolin-4-one Openeye Name: 2-hydroxy-1-methyl-3-[(3R)-3-(2-pyridylmethylamino)-3-(2-thienyl)propanoyl]quinolin-4-one CAS Name: 2-hydroxy-1-methyl-3-[(3R)-1-oxo-3-(2-pyridinylmethylamino)-3-thiophen-2-ylpropyl]-4-quinolinone IUPAC Name: 2-hydroxy-1-methyl-3-[(3R)-3-(pyridin-2-ylmethylamino)-3-thiophen-2-ylpropanoyl]quinolin-4-one Traditional Name: 2-hydroxy-1-methyl-3-[(3R)-3-(2-pyridylmethylamino)-3-(2-thienyl)propanoyl]-4-quinolone Formula: C23H21N3O3S MolecularWeight: 419.49614

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)CC(C3=CC=CS3)NCC4=CC=CC=N4

Isomeric SMILES

CN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)C[C@H](C3=CC=CS3)NCC4=CC=CC=N4

InChI

InChI=1S/C23H21N3O3S/c1-26-18-9-3-2-8-16(18)22(28)21(23(26)29)19(27)13-17(20-10-6-12-30-20)25-14-15-7-4-5-11-24-15/h2-12,17,25,29H,13-14H2,1H3/t17-/m1/s1