4-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-2-methyl-4-(2-morpholin-4-yl-1,3-thiazol-4-yl)butan-2-ol

Systemtic Name: 4-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-2-methyl-4-(2-morpholin-4-yl-1,3-thiazol-4-yl)butan-2-ol Openeye Name: 4-[4-(7-methoxy-8-quinolyl)-1,4-diazepan-1-yl]-2-methyl-4-(2-morpholinothiazol-4-yl)butan-2-ol CAS Name: 4-[4-(7-methoxy-8-quinolinyl)-1,4-diazepan-1-yl]-2-methyl-4-[2-(4-morpholinyl)-4-thiazolyl]-2-butanol IUPAC Name: 4-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-2-methyl-4-(2-morpholin-4-yl-1,3-thiazol-4-yl)butan-2-ol Traditional Name: 4-[4-(7-methoxy-8-quinolyl)-1,4-diazepan-1-yl]-2-methyl-4-(2-morpholinothiazol-4-yl)butan-2-ol Formula: C27H37N5O3S MolecularWeight: 511.67938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(C1=CSC(=N1)N2CCOCC2)N3CCCN(CC3)C4=C(C=CC5=C4N=CC=C5)OC)O

Isomeric SMILES

CC(C)(CC(C1=CSC(=N1)N2CCOCC2)N3CCCN(CC3)C4=C(C=CC5=C4N=CC=C5)OC)O

InChI

InChI=1S/C27H37N5O3S/c1-27(2,33)18-22(21-19-36-26(29-21)32-14-16-35-17-15-32)30-10-5-11-31(13-12-30)25-23(34-3)8-7-20-6-4-9-28-24(20)25/h4,6-9,19,22,33H,5,10-18H2,1-3H3