4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl-(4-pyridin-4-ylpiperazin-1-yl)methanone

Systemtic Name: 4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl-(4-pyridin-4-ylpiperazin-1-yl)methanone Openeye Name: 4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl-[4-(4-pyridyl)piperazin-1-yl]methanone CAS Name: 4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl-(4-pyridin-4-yl-1-piperazinyl)methanone IUPAC Name: 4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl-(4-pyridin-4-ylpiperazin-1-yl)methanone Traditional Name: 4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl-[4-(4-pyridyl)piperazino]methanone Formula: C20H25N3OS MolecularWeight: 355.497

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC2=C(CC1)C=C(S2)C(=O)N3CCN(CC3)C4=CC=NC=C4

Isomeric SMILES

C1CCCC2=C(CC1)C=C(S2)C(=O)N3CCN(CC3)C4=CC=NC=C4

InChI

InChI=1S/C20H25N3OS/c24-20(19-15-16-5-3-1-2-4-6-18(16)25-19)23-13-11-22(12-14-23)17-7-9-21-10-8-17/h7-10,15H,1-6,11-14H2