4-azanyl-2-methyl-3-phenylmethoxy-5-[2-(prop-2-enoylamino)ethanoyl]-N-pyrazin-2-yl-7-pyridin-3-yl-quinoline-6-carboxamide

Systemtic Name: 4-azanyl-2-methyl-3-phenylmethoxy-5-[2-(prop-2-enoylamino)ethanoyl]-N-pyrazin-2-yl-7-pyridin-3-yl-quinoline-6-carboxamide Openeye Name: 4-amino-3-benzyloxy-2-methyl-5-[2-(prop-2-enoylamino)acetyl]-N-pyrazin-2-yl-7-(3-pyridyl)quinoline-6-carboxamide CAS Name: 4-amino-2-methyl-5-[1-oxo-2-(1-oxoprop-2-enylamino)ethyl]-3-phenylmethoxy-N-(2-pyrazinyl)-7-(3-pyridinyl)-6-quinolinecarboxamide IUPAC Name: 4-amino-2-methyl-3-phenylmethoxy-5-[2-(prop-2-enoylamino)acetyl]-N-pyrazin-2-yl-7-pyridin-3-ylquinoline-6-carboxamide Traditional Name: 5-(2-acrylamidoacetyl)-4-amino-3-benzoxy-2-methyl-N-pyrazin-2-yl-7-(3-pyridyl)quinoline-6-carboxamide Formula: C32H27N7O4 MolecularWeight: 573.60128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=C(C(=C2)C3=CN=CC=C3)C(=O)NC4=NC=CN=C4)C(=O)CNC(=O)C=C)C(=C1OCC5=CC=CC=C5)N

Isomeric SMILES

CC1=NC2=C(C(=C(C(=C2)C3=CN=CC=C3)C(=O)NC4=NC=CN=C4)C(=O)CNC(=O)C=C)C(=C1OCC5=CC=CC=C5)N

InChI

InChI=1S/C32H27N7O4/c1-3-26(41)37-16-24(40)29-27(32(42)39-25-17-35-12-13-36-25)22(21-10-7-11-34-15-21)14-23-28(29)30(33)31(19(2)38-23)43-18-20-8-5-4-6-9-20/h3-15,17H,1,16,18H2,2H3,(H2,33,38)(H,37,41)(H,36,39,42)