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

Systemtic Name: azepan-1-yl-[5-methyl-4-[(4-phenyloxan-4-yl)methylamino]thieno[2,3-d]pyrimidin-6-yl]methanone Openeye Name: azepan-1-yl-[5-methyl-4-[(4-phenyltetrahydropyran-4-yl)methylamino]thieno[2,3-d]pyrimidin-6-yl]methanone CAS Name: 1-azepanyl-[5-methyl-4-[(4-phenyl-4-oxanyl)methylamino]-6-thieno[2,3-d]pyrimidinyl]methanone IUPAC Name: azepan-1-yl-[5-methyl-4-[(4-phenyloxan-4-yl)methylamino]thieno[2,3-d]pyrimidin-6-yl]methanone Traditional Name: azepan-1-yl-[5-methyl-4-[(4-phenyltetrahydropyran-4-yl)methylamino]thieno[2,3-d]pyrimidin-6-yl]methanone Formula: C26H32N4O2S MolecularWeight: 464.62288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NCC3(CCOCC3)C4=CC=CC=C4)C(=O)N5CCCCCC5

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NCC3(CCOCC3)C4=CC=CC=C4)C(=O)N5CCCCCC5

InChI

InChI=1S/C26H32N4O2S/c1-19-21-23(27-17-26(11-15-32-16-12-26)20-9-5-4-6-10-20)28-18-29-24(21)33-22(19)25(31)30-13-7-2-3-8-14-30/h4-6,9-10,18H,2-3,7-8,11-17H2,1H3,(H,27,28,29)