N-[3-[4-[[3-methyl-4-(6-methylpyridin-3-yl)oxy-phenyl]amino]quinazolin-6-yl]prop-2-ynyl]piperazine-1-carboxamide

Systemtic Name: N-[3-[4-[[3-methyl-4-(6-methylpyridin-3-yl)oxy-phenyl]amino]quinazolin-6-yl]prop-2-ynyl]piperazine-1-carboxamide Openeye Name: N-[3-[4-[3-methyl-4-[(6-methyl-3-pyridyl)oxy]anilino]quinazolin-6-yl]prop-2-ynyl]piperazine-1-carboxamide CAS Name: N-[3-[4-[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]anilino]-6-quinazolinyl]prop-2-ynyl]-1-piperazinecarboxamide IUPAC Name: N-[3-[4-[3-methyl-4-(6-methylpyridin-3-yl)oxyanilino]quinazolin-6-yl]prop-2-ynyl]piperazine-1-carboxamide Traditional Name: N-[3-[4-[3-methyl-4-[(6-methyl-3-pyridyl)oxy]anilino]quinazolin-6-yl]prop-2-ynyl]piperazine-1-carboxamide Formula: C29H29N7O2 MolecularWeight: 507.58626

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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)C#CCNC(=O)N5CCNCC5)C

Isomeric SMILES

CC1=NC=C(C=C1)OC2=C(C=C(C=C2)NC3=NC=NC4=C3C=C(C=C4)C#CCNC(=O)N5CCNCC5)C

InChI

InChI=1S/C29H29N7O2/c1-20-16-23(7-10-27(20)38-24-8-5-21(2)32-18-24)35-28-25-17-22(6-9-26(25)33-19-34-28)4-3-11-31-29(37)36-14-12-30-13-15-36/h5-10,16-19,30H,11-15H2,1-2H3,(H,31,37)(H,33,34,35)