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

Systemtic Name: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-3-(3-oxidanylidenepiperazin-1-yl)propanamide Openeye Name: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-3-(3-oxopiperazin-1-yl)propanamide CAS Name: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-3-(3-oxo-1-piperazinyl)propanamide IUPAC Name: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-3-(3-oxopiperazin-1-yl)propanamide Traditional Name: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-3-(3-ketopiperazino)propionamide Formula: C17H22N4O2S MolecularWeight: 346.44718

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(CC1)SC(=C2C#N)NC(=O)CCN3CCNC(=O)C3

Isomeric SMILES

C1CCC2=C(CC1)SC(=C2C#N)NC(=O)CCN3CCNC(=O)C3

InChI

InChI=1S/C17H22N4O2S/c18-10-13-12-4-2-1-3-5-14(12)24-17(13)20-15(22)6-8-21-9-7-19-16(23)11-21/h1-9,11H2,(H,19,23)(H,20,22)