N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-(3-oxidanylidenepiperazin-1-yl)ethanamide

Systemtic Name: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-(3-oxidanylidenepiperazin-1-yl)ethanamide Openeye Name: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-(3-oxopiperazin-1-yl)acetamide CAS Name: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-(3-oxo-1-piperazinyl)acetamide IUPAC Name: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-(3-oxopiperazin-1-yl)acetamide Traditional Name: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-(3-ketopiperazino)acetamide Formula: C16H20N4O2S MolecularWeight: 332.4206

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(CC1)SC(=C2C#N)NC(=O)CN3CCNC(=O)C3

Isomeric SMILES

C1CCC2=C(CC1)SC(=C2C#N)NC(=O)CN3CCNC(=O)C3

InChI

InChI=1S/C16H20N4O2S/c17-8-12-11-4-2-1-3-5-13(11)23-16(12)19-15(22)10-20-7-6-18-14(21)9-20/h1-7,9-10H2,(H,18,21)(H,19,22)