4-[4-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylcarbonyl)piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 4-[4-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylcarbonyl)piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 4-[4-(5,6-dihydro-4H-cyclopenta[b]thiophene-2-carbonyl)piperazin-1-yl]sulfonylbenzonitrile CAS Name: 4-[[4-[5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl(oxo)methyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 4-[4-(5,6-dihydro-4H-cyclopenta[b]thiophene-2-carbonyl)piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 4-[4-(5,6-dihydro-4H-cyclopenta[b]thiophene-2-carbonyl)piperazino]sulfonylbenzonitrile Formula: C19H19N3O3S2 MolecularWeight: 401.50246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)SC(=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1CC2=C(C1)SC(=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C19H19N3O3S2/c20-13-14-4-6-16(7-5-14)27(24,25)22-10-8-21(9-11-22)19(23)18-12-15-2-1-3-17(15)26-18/h4-7,12H,1-3,8-11H2