3,5-dihydro-2H-1,4-benzoxazepin-4-yl-[5-methyl-4-(pyridin-2-ylmethylamino)thieno[2,3-d]pyrimidin-6-yl]methanone

Systemtic Name: 3,5-dihydro-2H-1,4-benzoxazepin-4-yl-[5-methyl-4-(pyridin-2-ylmethylamino)thieno[2,3-d]pyrimidin-6-yl]methanone Openeye Name: 3,5-dihydro-2H-1,4-benzoxazepin-4-yl-[5-methyl-4-(2-pyridylmethylamino)thieno[2,3-d]pyrimidin-6-yl]methanone CAS Name: 3,5-dihydro-2H-1,4-benzoxazepin-4-yl-[5-methyl-4-(2-pyridinylmethylamino)-6-thieno[2,3-d]pyrimidinyl]methanone IUPAC Name: 3,5-dihydro-2H-1,4-benzoxazepin-4-yl-[5-methyl-4-(pyridin-2-ylmethylamino)thieno[2,3-d]pyrimidin-6-yl]methanone Traditional Name: 3,5-dihydro-2H-1,4-benzoxazepin-4-yl-[5-methyl-4-(2-pyridylmethylamino)thieno[2,3-d]pyrimidin-6-yl]methanone Formula: C23H21N5O2S MolecularWeight: 431.51014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NCC3=CC=CC=N3)C(=O)N4CCOC5=CC=CC=C5C4

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NCC3=CC=CC=N3)C(=O)N4CCOC5=CC=CC=C5C4

InChI

InChI=1S/C23H21N5O2S/c1-15-19-21(25-12-17-7-4-5-9-24-17)26-14-27-22(19)31-20(15)23(29)28-10-11-30-18-8-3-2-6-16(18)13-28/h2-9,14H,10-13H2,1H3,(H,25,26,27)