N-(2-cyanoethyl)-4-[4-(cyclopropylcarbamoylamino)-3-fluoranyl-phenoxy]-7-methoxy-quinoline-6-carboxamide

Systemtic Name: N-(2-cyanoethyl)-4-[4-(cyclopropylcarbamoylamino)-3-fluoranyl-phenoxy]-7-methoxy-quinoline-6-carboxamide Openeye Name: N-(2-cyanoethyl)-4-[4-(cyclopropylcarbamoylamino)-3-fluoro-phenoxy]-7-methoxy-quinoline-6-carboxamide CAS Name: N-(2-cyanoethyl)-4-[4-[[(cyclopropylamino)-oxomethyl]amino]-3-fluorophenoxy]-7-methoxy-6-quinolinecarboxamide IUPAC Name: N-(2-cyanoethyl)-4-[4-(cyclopropylcarbamoylamino)-3-fluorophenoxy]-7-methoxyquinoline-6-carboxamide Traditional Name: N-(2-cyanoethyl)-4-[4-(cyclopropylcarbamoylamino)-3-fluoro-phenoxy]-7-methoxy-quinoline-6-carboxamide Formula: C24H22FN5O4 MolecularWeight: 463.460983

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=NC=CC(=C2C=C1C(=O)NCCC#N)OC3=CC(=C(C=C3)NC(=O)NC4CC4)F

Isomeric SMILES

COC1=CC2=NC=CC(=C2C=C1C(=O)NCCC#N)OC3=CC(=C(C=C3)NC(=O)NC4CC4)F

InChI

InChI=1S/C24H22FN5O4/c1-33-22-13-20-16(12-17(22)23(31)28-9-2-8-26)21(7-10-27-20)34-15-5-6-19(18(25)11-15)30-24(32)29-14-3-4-14/h5-7,10-14H,2-4,9H2,1H3,(H,28,31)(H2,29,30,32)