N-(4-morpholin-4-ylsulfonylphenyl)-3-(4,6,8-trimethylquinolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(4-morpholin-4-ylsulfonylphenyl)-3-(4,6,8-trimethylquinolin-2-yl)sulfanyl-propanamide Openeye Name: N-(4-morpholinosulfonylphenyl)-3-[(4,6,8-trimethyl-2-quinolyl)sulfanyl]propanamide CAS Name: N-[4-(4-morpholinylsulfonyl)phenyl]-3-[(4,6,8-trimethyl-2-quinolinyl)thio]propanamide IUPAC Name: N-(4-morpholin-4-ylsulfonylphenyl)-3-(4,6,8-trimethylquinolin-2-yl)sulfanylpropanamide Traditional Name: N-(4-morpholinosulfonylphenyl)-3-[(4,6,8-trimethyl-2-quinolyl)thio]propionamide Formula: C25H29N3O4S2 MolecularWeight: 499.64546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)SCCC(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)SCCC(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)C)C

InChI

InChI=1S/C25H29N3O4S2/c1-17-14-19(3)25-22(15-17)18(2)16-24(27-25)33-13-8-23(29)26-20-4-6-21(7-5-20)34(30,31)28-9-11-32-12-10-28/h4-7,14-16H,8-13H2,1-3H3,(H,26,29)