5-[5-azanyl-2-methyl-4-morpholin-4-yl-3-phenylmethoxy-6-[2-(prop-2-enoylamino)ethanoyl]quinolin-7-yl]-N-methyl-pyridine-2-carboxamide

Systemtic Name: 5-[5-azanyl-2-methyl-4-morpholin-4-yl-3-phenylmethoxy-6-[2-(prop-2-enoylamino)ethanoyl]quinolin-7-yl]-N-methyl-pyridine-2-carboxamide Openeye Name: 5-[5-amino-3-benzyloxy-2-methyl-4-morpholino-6-[2-(prop-2-enoylamino)acetyl]-7-quinolyl]-N-methyl-pyridine-2-carboxamide CAS Name: 5-[5-amino-2-methyl-4-(4-morpholinyl)-6-[1-oxo-2-(1-oxoprop-2-enylamino)ethyl]-3-phenylmethoxy-7-quinolinyl]-N-methyl-2-pyridinecarboxamide IUPAC Name: 5-[5-amino-2-methyl-4-morpholin-4-yl-3-phenylmethoxy-6-[2-(prop-2-enoylamino)acetyl]quinolin-7-yl]-N-methylpyridine-2-carboxamide Traditional Name: 5-[6-(2-acrylamidoacetyl)-5-amino-3-benzoxy-2-methyl-4-morpholino-7-quinolyl]-N-methyl-picolinamide Formula: C33H34N6O5 MolecularWeight: 594.66026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=C(C(=C2)C3=CN=C(C=C3)C(=O)NC)C(=O)CNC(=O)C=C)N)C(=C1OCC4=CC=CC=C4)N5CCOCC5

Isomeric SMILES

CC1=NC2=C(C(=C(C(=C2)C3=CN=C(C=C3)C(=O)NC)C(=O)CNC(=O)C=C)N)C(=C1OCC4=CC=CC=C4)N5CCOCC5

InChI

InChI=1S/C33H34N6O5/c1-4-27(41)37-18-26(40)28-23(22-10-11-24(36-17-22)33(42)35-3)16-25-29(30(28)34)31(39-12-14-43-15-13-39)32(20(2)38-25)44-19-21-8-6-5-7-9-21/h4-11,16-17H,1,12-15,18-19,34H2,2-3H3,(H,35,42)(H,37,41)