2-(3,5-dihydro-2H-1,4-benzoxazepin-4-ylmethyl)-1H-thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 2-(3,5-dihydro-2H-1,4-benzoxazepin-4-ylmethyl)-1H-thieno[3,2-d]pyrimidin-4-one Openeye Name: 2-(3,5-dihydro-2H-1,4-benzoxazepin-4-ylmethyl)-1H-thieno[3,2-d]pyrimidin-4-one CAS Name: 2-(3,5-dihydro-2H-1,4-benzoxazepin-4-ylmethyl)-1H-thieno[3,2-d]pyrimidin-4-one IUPAC Name: 2-(3,5-dihydro-2H-1,4-benzoxazepin-4-ylmethyl)-1H-thieno[3,2-d]pyrimidin-4-one Traditional Name: 2-(3,5-dihydro-2H-1,4-benzoxazepin-4-ylmethyl)-1H-thieno[3,2-d]pyrimidin-4-one Formula: C16H15N3O2S MolecularWeight: 313.3742

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC=C2CN1CC3=NC(=O)C4=C(N3)C=CS4

Isomeric SMILES

C1COC2=CC=CC=C2CN1CC3=NC(=O)C4=C(N3)C=CS4

InChI

InChI=1S/C16H15N3O2S/c20-16-15-12(5-8-22-15)17-14(18-16)10-19-6-7-21-13-4-2-1-3-11(13)9-19/h1-5,8H,6-7,9-10H2,(H,17,18,20)