4-[3-chloranyl-2-[(3-fluorophenyl)methoxy]phenyl]-6-[2-[2-(2-propylsulfonylethylamino)ethyl]-1,3-thiazol-4-yl]-1H-pyrido[3,4-d]pyrimidin-4-amine

Systemtic Name: 4-[3-chloranyl-2-[(3-fluorophenyl)methoxy]phenyl]-6-[2-[2-(2-propylsulfonylethylamino)ethyl]-1,3-thiazol-4-yl]-1H-pyrido[3,4-d]pyrimidin-4-amine Openeye Name: 4-[3-chloro-2-[(3-fluorophenyl)methoxy]phenyl]-6-[2-[2-(2-propylsulfonylethylamino)ethyl]thiazol-4-yl]-1H-pyrido[3,4-d]pyrimidin-4-amine CAS Name: 4-[3-chloro-2-[(3-fluorophenyl)methoxy]phenyl]-6-[2-[2-(2-propylsulfonylethylamino)ethyl]-4-thiazolyl]-1H-pyrido[3,4-d]pyrimidin-4-amine IUPAC Name: 4-[3-chloro-2-[(3-fluorophenyl)methoxy]phenyl]-6-[2-[2-(2-propylsulfonylethylamino)ethyl]-1,3-thiazol-4-yl]-1H-pyrido[3,4-d]pyrimidin-4-amine Traditional Name: 2-[4-[4-amino-4-[3-chloro-2-(3-fluorobenzyl)oxy-phenyl]-1H-pyrido[3,4-d]pyrimidin-6-yl]thiazol-2-yl]ethyl-(2-propylsulfonylethyl)amine Formula: C30H32ClFN6O3S2 MolecularWeight: 643.194883

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)CCNCCC1=NC(=CS1)C2=NC=C3C(=C2)C(N=CN3)(C4=C(C(=CC=C4)Cl)OCC5=CC(=CC=C5)F)N

Isomeric SMILES

CCCS(=O)(=O)CCNCCC1=NC(=CS1)C2=NC=C3C(=C2)C(N=CN3)(C4=C(C(=CC=C4)Cl)OCC5=CC(=CC=C5)F)N

InChI

InChI=1S/C30H32ClFN6O3S2/c1-2-12-43(39,40)13-11-34-10-9-28-38-27(18-42-28)25-15-23-26(16-35-25)36-19-37-30(23,33)22-7-4-8-24(31)29(22)41-17-20-5-3-6-21(32)14-20/h3-8,14-16,18-19,34H,2,9-13,17,33H2,1H3,(H,36,37)