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

Systemtic Name: 4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl-(4-phenylpiperazin-1-yl)methanone Openeye Name: 4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl-(4-phenylpiperazin-1-yl)methanone CAS Name: 4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl-(4-phenyl-1-piperazinyl)methanone IUPAC Name: 4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl-(4-phenylpiperazin-1-yl)methanone Traditional Name: 4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl-(4-phenylpiperazino)methanone Formula: C21H26N2OS MolecularWeight: 354.50894

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2OS/c24-21(20-16-17-8-4-1-2-7-11-19(17)25-20)23-14-12-22(13-15-23)18-9-5-3-6-10-18/h3,5-6,9-10,16H,1-2,4,7-8,11-15H2