N-[4-[(E)-3-[[2-[[2,4-bis(chloranyl)-3-[[2-methyl-4-(pyridin-2-ylmethoxy)quinolin-8-yl]oxymethyl]phenyl]-methyl-amino]-2-oxidanylidene-ethyl]amino]-3-oxidanylidene-prop-1-enyl]phenyl]pyridine-4-carboxamide

Systemtic Name: N-[4-[(E)-3-[[2-[[2,4-bis(chloranyl)-3-[[2-methyl-4-(pyridin-2-ylmethoxy)quinolin-8-yl]oxymethyl]phenyl]-methyl-amino]-2-oxidanylidene-ethyl]amino]-3-oxidanylidene-prop-1-enyl]phenyl]pyridine-4-carboxamide Openeye Name: N-[4-[(E)-3-[[2-[2,4-dichloro-N-methyl-3-[[2-methyl-4-(2-pyridylmethoxy)-8-quinolyl]oxymethyl]anilino]-2-oxo-ethyl]amino]-3-oxo-prop-1-enyl]phenyl]pyridine-4-carboxamide CAS Name: N-[4-[(E)-3-[[2-[2,4-dichloro-N-methyl-3-[[2-methyl-4-(2-pyridinylmethoxy)-8-quinolinyl]oxymethyl]anilino]-2-oxoethyl]amino]-3-oxoprop-1-enyl]phenyl]-4-pyridinecarboxamide IUPAC Name: N-[4-[(E)-3-[[2-[2,4-dichloro-N-methyl-3-[[2-methyl-4-(pyridin-2-ylmethoxy)quinolin-8-yl]oxymethyl]anilino]-2-oxoethyl]amino]-3-oxoprop-1-enyl]phenyl]pyridine-4-carboxamide Traditional Name: N-[4-[(E)-3-[[2-[2,4-dichloro-N-methyl-3-[[2-methyl-4-(2-pyridylmethoxy)-8-quinolyl]oxymethyl]anilino]-2-keto-ethyl]amino]-3-keto-prop-1-enyl]phenyl]isonicotinamide Formula: C41H34Cl2N6O5 MolecularWeight: 761.65186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2OCC3=C(C=CC(=C3Cl)N(C)C(=O)CNC(=O)C=CC4=CC=C(C=C4)NC(=O)C5=CC=NC=C5)Cl)C(=C1)OCC6=CC=CC=N6

Isomeric SMILES

CC1=NC2=C(C=CC=C2OCC3=C(C=CC(=C3Cl)N(C)C(=O)CNC(=O)/C=C/C4=CC=C(C=C4)NC(=O)C5=CC=NC=C5)Cl)C(=C1)OCC6=CC=CC=N6

InChI

InChI=1S/C41H34Cl2N6O5/c1-26-22-36(53-24-30-6-3-4-19-45-30)31-7-5-8-35(40(31)47-26)54-25-32-33(42)14-15-34(39(32)43)49(2)38(51)23-46-37(50)16-11-27-9-12-29(13-10-27)48-41(52)28-17-20-44-21-18-28/h3-22H,23-25H2,1-2H3,(H,46,50)(H,48,52)/b16-11+