[2,5-dimethyl-4-[methyl-(4-propan-2-ylphenyl)amino]thieno[2,3-d]pyrimidin-6-yl]-[4-(2-fluorophenyl)piperazin-1-yl]methanone

Systemtic Name: [2,5-dimethyl-4-[methyl-(4-propan-2-ylphenyl)amino]thieno[2,3-d]pyrimidin-6-yl]-[4-(2-fluorophenyl)piperazin-1-yl]methanone Openeye Name: [4-(2-fluorophenyl)piperazin-1-yl]-[4-(4-isopropyl-N-methyl-anilino)-2,5-dimethyl-thieno[2,3-d]pyrimidin-6-yl]methanone CAS Name: [2,5-dimethyl-4-(N-methyl-4-propan-2-ylanilino)-6-thieno[2,3-d]pyrimidinyl]-[4-(2-fluorophenyl)-1-piperazinyl]methanone IUPAC Name: [2,5-dimethyl-4-(N-methyl-4-propan-2-ylanilino)thieno[2,3-d]pyrimidin-6-yl]-[4-(2-fluorophenyl)piperazin-1-yl]methanone Traditional Name: [4-(2-fluorophenyl)piperazino]-[4-(4-isopropyl-N-methyl-anilino)-2,5-dimethyl-thieno[2,3-d]pyrimidin-6-yl]methanone Formula: C29H32FN5OS MolecularWeight: 517.660683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)N(C)C3=CC=C(C=C3)C(C)C)C)C(=O)N4CCN(CC4)C5=CC=CC=C5F

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)N(C)C3=CC=C(C=C3)C(C)C)C)C(=O)N4CCN(CC4)C5=CC=CC=C5F

InChI

InChI=1S/C29H32FN5OS/c1-18(2)21-10-12-22(13-11-21)33(5)27-25-19(3)26(37-28(25)32-20(4)31-27)29(36)35-16-14-34(15-17-35)24-9-7-6-8-23(24)30/h6-13,18H,14-17H2,1-5H3