azepan-1-yl-[5-methyl-4-[(6-methylpyridin-2-yl)methylamino]thieno[2,3-d]pyrimidin-6-yl]methanone

Systemtic Name: azepan-1-yl-[5-methyl-4-[(6-methylpyridin-2-yl)methylamino]thieno[2,3-d]pyrimidin-6-yl]methanone Openeye Name: azepan-1-yl-[5-methyl-4-[(6-methyl-2-pyridyl)methylamino]thieno[2,3-d]pyrimidin-6-yl]methanone CAS Name: 1-azepanyl-[5-methyl-4-[(6-methyl-2-pyridinyl)methylamino]-6-thieno[2,3-d]pyrimidinyl]methanone IUPAC Name: azepan-1-yl-[5-methyl-4-[(6-methylpyridin-2-yl)methylamino]thieno[2,3-d]pyrimidin-6-yl]methanone Traditional Name: azepan-1-yl-[5-methyl-4-[(6-methyl-2-pyridyl)methylamino]thieno[2,3-d]pyrimidin-6-yl]methanone Formula: C21H25N5OS MolecularWeight: 395.5211

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)CNC2=C3C(=C(SC3=NC=N2)C(=O)N4CCCCCC4)C

Isomeric SMILES

CC1=NC(=CC=C1)CNC2=C3C(=C(SC3=NC=N2)C(=O)N4CCCCCC4)C

InChI

InChI=1S/C21H25N5OS/c1-14-8-7-9-16(25-14)12-22-19-17-15(2)18(28-20(17)24-13-23-19)21(27)26-10-5-3-4-6-11-26/h7-9,13H,3-6,10-12H2,1-2H3,(H,22,23,24)