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

Systemtic Name: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-3-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]propanamide Openeye Name: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-3-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]propanamide CAS Name: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-3-[4-(3-fluorophenyl)sulfonyl-1-piperazinyl]propanamide IUPAC Name: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-3-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]propanamide Traditional Name: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-3-[4-(3-fluorophenyl)sulfonylpiperazino]propionamide Formula: C23H27FN4O3S2 MolecularWeight: 490.613883

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(CC1)SC(=C2C#N)NC(=O)CCN3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)F

Isomeric SMILES

C1CCC2=C(CC1)SC(=C2C#N)NC(=O)CCN3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)F

InChI

InChI=1S/C23H27FN4O3S2/c24-17-5-4-6-18(15-17)33(30,31)28-13-11-27(12-14-28)10-9-22(29)26-23-20(16-25)19-7-2-1-3-8-21(19)32-23/h4-6,15H,1-3,7-14H2,(H,26,29)