N-[4-[[3-methyl-4-(6-methylpyridin-3-yl)oxy-phenyl]amino]quinazolin-6-yl]-4-(prop-2-enoylamino)butanamide

Systemtic Name: N-[4-[[3-methyl-4-(6-methylpyridin-3-yl)oxy-phenyl]amino]quinazolin-6-yl]-4-(prop-2-enoylamino)butanamide Openeye Name: N-[4-[3-methyl-4-[(6-methyl-3-pyridyl)oxy]anilino]quinazolin-6-yl]-4-(prop-2-enoylamino)butanamide CAS Name: N-[4-[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]anilino]-6-quinazolinyl]-4-(1-oxoprop-2-enylamino)butanamide IUPAC Name: N-[4-[3-methyl-4-(6-methylpyridin-3-yl)oxyanilino]quinazolin-6-yl]-4-(prop-2-enoylamino)butanamide Traditional Name: 4-acrylamido-N-[4-[3-methyl-4-[(6-methyl-3-pyridyl)oxy]anilino]quinazolin-6-yl]butyramide Formula: C28H28N6O3 MolecularWeight: 496.56032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)OC2=C(C=C(C=C2)NC3=NC=NC4=C3C=C(C=C4)NC(=O)CCCNC(=O)C=C)C

Isomeric SMILES

CC1=NC=C(C=C1)OC2=C(C=C(C=C2)NC3=NC=NC4=C3C=C(C=C4)NC(=O)CCCNC(=O)C=C)C

InChI

InChI=1S/C28H28N6O3/c1-4-26(35)29-13-5-6-27(36)33-21-8-11-24-23(15-21)28(32-17-31-24)34-20-9-12-25(18(2)14-20)37-22-10-7-19(3)30-16-22/h4,7-12,14-17H,1,5-6,13H2,2-3H3,(H,29,35)(H,33,36)(H,31,32,34)