N-[3-chloranyl-4-(1,3-thiazol-4-ylmethoxy)phenyl]-6-[2-[(2S)-1-(methylsulfonylmethyl)pyrrolidin-2-yl]ethynyl]thieno[3,2-d]pyrimidin-4-amine

Systemtic Name: N-[3-chloranyl-4-(1,3-thiazol-4-ylmethoxy)phenyl]-6-[2-[(2S)-1-(methylsulfonylmethyl)pyrrolidin-2-yl]ethynyl]thieno[3,2-d]pyrimidin-4-amine Openeye Name: N-[3-chloro-4-(thiazol-4-ylmethoxy)phenyl]-6-[2-[(2S)-1-(methylsulfonylmethyl)pyrrolidin-2-yl]ethynyl]thieno[3,2-d]pyrimidin-4-amine CAS Name: N-[3-chloro-4-(4-thiazolylmethoxy)phenyl]-6-[2-[(2S)-1-(methylsulfonylmethyl)-2-pyrrolidinyl]ethynyl]-4-thieno[3,2-d]pyrimidinamine IUPAC Name: N-[3-chloro-4-(1,3-thiazol-4-ylmethoxy)phenyl]-6-[2-[(2S)-1-(methylsulfonylmethyl)pyrrolidin-2-yl]ethynyl]thieno[3,2-d]pyrimidin-4-amine Traditional Name: [3-chloro-4-(thiazol-4-ylmethoxy)phenyl]-[6-[2-[(2S)-1-(mesylmethyl)pyrrolidin-2-yl]ethynyl]thieno[3,2-d]pyrimidin-4-yl]amine Formula: C24H22ClN5O3S3 MolecularWeight: 560.11118

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CN1CCCC1C#CC2=CC3=C(S2)C(=NC=N3)NC4=CC(=C(C=C4)OCC5=CSC=N5)Cl

Isomeric SMILES

CS(=O)(=O)CN1CCC[C@H]1C#CC2=CC3=C(S2)C(=NC=N3)NC4=CC(=C(C=C4)OCC5=CSC=N5)Cl

InChI

InChI=1S/C24H22ClN5O3S3/c1-36(31,32)15-30-8-2-3-18(30)5-6-19-10-21-23(35-19)24(27-13-26-21)29-16-4-7-22(20(25)9-16)33-11-17-12-34-14-28-17/h4,7,9-10,12-14,18H,2-3,8,11,15H2,1H3,(H,26,27,29)/t18-/m0/s1