N-[3-[4-[[3-chloranyl-4-[(3-fluorophenyl)methoxy]phenyl]amino]thieno[3,2-d]pyrimidin-6-yl]prop-2-ynyl]-2-pyridin-4-yl-1,3-thiazole-4-carboxamide

Systemtic Name: N-[3-[4-[[3-chloranyl-4-[(3-fluorophenyl)methoxy]phenyl]amino]thieno[3,2-d]pyrimidin-6-yl]prop-2-ynyl]-2-pyridin-4-yl-1,3-thiazole-4-carboxamide Openeye Name: N-[3-[4-[3-chloro-4-[(3-fluorophenyl)methoxy]anilino]thieno[3,2-d]pyrimidin-6-yl]prop-2-ynyl]-2-(4-pyridyl)thiazole-4-carboxamide CAS Name: N-[3-[4-[3-chloro-4-[(3-fluorophenyl)methoxy]anilino]-6-thieno[3,2-d]pyrimidinyl]prop-2-ynyl]-2-pyridin-4-yl-4-thiazolecarboxamide IUPAC Name: N-[3-[4-[3-chloro-4-[(3-fluorophenyl)methoxy]anilino]thieno[3,2-d]pyrimidin-6-yl]prop-2-ynyl]-2-pyridin-4-yl-1,3-thiazole-4-carboxamide Traditional Name: N-[3-[4-[3-chloro-4-(3-fluorobenzyl)oxy-anilino]thieno[3,2-d]pyrimidin-6-yl]prop-2-ynyl]-2-(4-pyridyl)thiazole-4-carboxamide Formula: C31H20ClFN6O2S2 MolecularWeight: 627.110903

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)COC2=C(C=C(C=C2)NC3=NC=NC4=C3SC(=C4)C#CCNC(=O)C5=CSC(=N5)C6=CC=NC=C6)Cl

Isomeric SMILES

C1=CC(=CC(=C1)F)COC2=C(C=C(C=C2)NC3=NC=NC4=C3SC(=C4)C#CCNC(=O)C5=CSC(=N5)C6=CC=NC=C6)Cl

InChI

InChI=1S/C31H20ClFN6O2S2/c32-24-14-22(6-7-27(24)41-16-19-3-1-4-21(33)13-19)38-29-28-25(36-18-37-29)15-23(43-28)5-2-10-35-30(40)26-17-42-31(39-26)20-8-11-34-12-9-20/h1,3-4,6-9,11-15,17-18H,10,16H2,(H,35,40)(H,36,37,38)