1-[4-[6-cyano-7-(2-methoxyethoxy)quinolin-4-yl]oxyphenyl]-3-methylsulfonyl-urea

Systemtic Name: 1-[4-[6-cyano-7-(2-methoxyethoxy)quinolin-4-yl]oxyphenyl]-3-methylsulfonyl-urea Openeye Name: 1-[4-[[6-cyano-7-(2-methoxyethoxy)-4-quinolyl]oxy]phenyl]-3-methylsulfonyl-urea CAS Name: 1-[4-[[6-cyano-7-(2-methoxyethoxy)-4-quinolinyl]oxy]phenyl]-3-methylsulfonylurea IUPAC Name: 1-[4-[6-cyano-7-(2-methoxyethoxy)quinolin-4-yl]oxyphenyl]-3-methylsulfonylurea Traditional Name: 1-[4-[[6-cyano-7-(2-methoxyethoxy)-4-quinolyl]oxy]phenyl]-3-mesyl-urea Formula: C21H20N4O6S MolecularWeight: 456.4717

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=CC2=NC=CC(=C2C=C1C#N)OC3=CC=C(C=C3)NC(=O)NS(=O)(=O)C

Isomeric SMILES

COCCOC1=CC2=NC=CC(=C2C=C1C#N)OC3=CC=C(C=C3)NC(=O)NS(=O)(=O)C

InChI

InChI=1S/C21H20N4O6S/c1-29-9-10-30-20-12-18-17(11-14(20)13-22)19(7-8-23-18)31-16-5-3-15(4-6-16)24-21(26)25-32(2,27)28/h3-8,11-12H,9-10H2,1-2H3,(H2,24,25,26)