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

Systemtic Name: azepan-1-yl-[5-methyl-4-(pyridin-2-ylmethylamino)thieno[2,3-d]pyrimidin-6-yl]methanone Openeye Name: azepan-1-yl-[5-methyl-4-(2-pyridylmethylamino)thieno[2,3-d]pyrimidin-6-yl]methanone CAS Name: 1-azepanyl-[5-methyl-4-(2-pyridinylmethylamino)-6-thieno[2,3-d]pyrimidinyl]methanone IUPAC Name: azepan-1-yl-[5-methyl-4-(pyridin-2-ylmethylamino)thieno[2,3-d]pyrimidin-6-yl]methanone Traditional Name: azepan-1-yl-[5-methyl-4-(2-pyridylmethylamino)thieno[2,3-d]pyrimidin-6-yl]methanone Formula: C20H23N5OS MolecularWeight: 381.49452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NCC3=CC=CC=N3)C(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NCC3=CC=CC=N3)C(=O)N4CCCCCC4

InChI

InChI=1S/C20H23N5OS/c1-14-16-18(22-12-15-8-4-5-9-21-15)23-13-24-19(16)27-17(14)20(26)25-10-6-2-3-7-11-25/h4-5,8-9,13H,2-3,6-7,10-12H2,1H3,(H,22,23,24)