N-(1-cyanocycloheptyl)-2-(4-oxidanylidenethieno[3,2-d]pyrimidin-3-yl)ethanamide

Systemtic Name: N-(1-cyanocycloheptyl)-2-(4-oxidanylidenethieno[3,2-d]pyrimidin-3-yl)ethanamide Openeye Name: N-(1-cyanocycloheptyl)-2-(4-oxothieno[3,2-d]pyrimidin-3-yl)acetamide CAS Name: N-(1-cyanocycloheptyl)-2-(4-oxo-3-thieno[3,2-d]pyrimidinyl)acetamide IUPAC Name: N-(1-cyanocycloheptyl)-2-(4-oxothieno[3,2-d]pyrimidin-3-yl)acetamide Traditional Name: N-(1-cyanocycloheptyl)-2-(4-ketothieno[3,2-d]pyrimidin-3-yl)acetamide Formula: C16H18N4O2S MolecularWeight: 330.40472

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)(C#N)NC(=O)CN2C=NC3=C(C2=O)SC=C3

Isomeric SMILES

C1CCCC(CC1)(C#N)NC(=O)CN2C=NC3=C(C2=O)SC=C3

InChI

InChI=1S/C16H18N4O2S/c17-10-16(6-3-1-2-4-7-16)19-13(21)9-20-11-18-12-5-8-23-14(12)15(20)22/h5,8,11H,1-4,6-7,9H2,(H,19,21)