azepan-1-yl-(6-morpholin-4-ylsulfonyl-2-pyridin-2-yl-quinolin-4-yl)methanone

Systemtic Name: azepan-1-yl-(6-morpholin-4-ylsulfonyl-2-pyridin-2-yl-quinolin-4-yl)methanone Openeye Name: azepan-1-yl-[6-morpholinosulfonyl-2-(2-pyridyl)-4-quinolyl]methanone CAS Name: 1-azepanyl-[6-(4-morpholinylsulfonyl)-2-(2-pyridinyl)-4-quinolinyl]methanone IUPAC Name: azepan-1-yl-(6-morpholin-4-ylsulfonyl-2-pyridin-2-ylquinolin-4-yl)methanone Traditional Name: azepan-1-yl-[6-morpholinosulfonyl-2-(2-pyridyl)-4-quinolyl]methanone Formula: C25H28N4O4S MolecularWeight: 480.57922

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=CC(=NC3=C2C=C(C=C3)S(=O)(=O)N4CCOCC4)C5=CC=CC=N5

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=CC(=NC3=C2C=C(C=C3)S(=O)(=O)N4CCOCC4)C5=CC=CC=N5

InChI

InChI=1S/C25H28N4O4S/c30-25(28-11-5-1-2-6-12-28)21-18-24(23-7-3-4-10-26-23)27-22-9-8-19(17-20(21)22)34(31,32)29-13-15-33-16-14-29/h3-4,7-10,17-18H,1-2,5-6,11-16H2