N-(3-pyrazol-1-ylpropyl)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-2-carboxamide

Systemtic Name: N-(3-pyrazol-1-ylpropyl)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-2-carboxamide Openeye Name: N-(3-pyrazol-1-ylpropyl)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-2-carboxamide CAS Name: N-[3-(1-pyrazolyl)propyl]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-2-carboxamide IUPAC Name: N-(3-pyrazol-1-ylpropyl)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-2-carboxamide Traditional Name: N-(3-pyrazol-1-ylpropyl)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-2-carboxamide Formula: C17H23N3OS MolecularWeight: 317.44902

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC2=C(CC1)C=C(S2)C(=O)NCCCN3C=CC=N3

Isomeric SMILES

C1CCCC2=C(CC1)C=C(S2)C(=O)NCCCN3C=CC=N3

InChI

InChI=1S/C17H23N3OS/c21-17(18-9-5-11-20-12-6-10-19-20)16-13-14-7-3-1-2-4-8-15(14)22-16/h6,10,12-13H,1-5,7-9,11H2,(H,18,21)