N-[3-[4-[[3-chloranyl-4-[(3-fluorophenyl)methoxy]phenyl]amino]thieno[3,2-d]pyrimidin-6-yl]prop-2-ynyl]-2-(3,4-dichlorophenyl)ethanamide

Systemtic Name: N-[3-[4-[[3-chloranyl-4-[(3-fluorophenyl)methoxy]phenyl]amino]thieno[3,2-d]pyrimidin-6-yl]prop-2-ynyl]-2-(3,4-dichlorophenyl)ethanamide Openeye Name: N-[3-[4-[3-chloro-4-[(3-fluorophenyl)methoxy]anilino]thieno[3,2-d]pyrimidin-6-yl]prop-2-ynyl]-2-(3,4-dichlorophenyl)acetamide CAS Name: N-[3-[4-[3-chloro-4-[(3-fluorophenyl)methoxy]anilino]-6-thieno[3,2-d]pyrimidinyl]prop-2-ynyl]-2-(3,4-dichlorophenyl)acetamide IUPAC Name: N-[3-[4-[3-chloro-4-[(3-fluorophenyl)methoxy]anilino]thieno[3,2-d]pyrimidin-6-yl]prop-2-ynyl]-2-(3,4-dichlorophenyl)acetamide Traditional Name: N-[3-[4-[3-chloro-4-(3-fluorobenzyl)oxy-anilino]thieno[3,2-d]pyrimidin-6-yl]prop-2-ynyl]-2-(3,4-dichlorophenyl)acetamide Formula: C30H20Cl3FN4O2S MolecularWeight: 625.927803

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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)CC5=CC(=C(C=C5)Cl)Cl)Cl

Isomeric SMILES

C1=CC(=CC(=C1)F)COC2=C(C=C(C=C2)NC3=NC=NC4=C3SC(=C4)C#CCNC(=O)CC5=CC(=C(C=C5)Cl)Cl)Cl

InChI

InChI=1S/C30H20Cl3FN4O2S/c31-23-8-6-18(12-24(23)32)13-28(39)35-10-2-5-22-15-26-29(41-22)30(37-17-36-26)38-21-7-9-27(25(33)14-21)40-16-19-3-1-4-20(34)11-19/h1,3-4,6-9,11-12,14-15,17H,10,13,16H2,(H,35,39)(H,36,37,38)