N-(2-pyridin-3-ylethyl)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-2-carboxamide

Systemtic Name: N-(2-pyridin-3-ylethyl)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-2-carboxamide Openeye Name: N-[2-(3-pyridyl)ethyl]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-2-carboxamide CAS Name: N-[2-(3-pyridinyl)ethyl]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-2-carboxamide IUPAC Name: N-(2-pyridin-3-ylethyl)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-2-carboxamide Traditional Name: N-[2-(3-pyridyl)ethyl]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-2-carboxamide Formula: C18H22N2OS MolecularWeight: 314.44508

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC2=C(CC1)C=C(S2)C(=O)NCCC3=CN=CC=C3

Isomeric SMILES

C1CCCC2=C(CC1)C=C(S2)C(=O)NCCC3=CN=CC=C3

InChI

InChI=1S/C18H22N2OS/c21-18(20-11-9-14-6-5-10-19-13-14)17-12-15-7-3-1-2-4-8-16(15)22-17/h5-6,10,12-13H,1-4,7-9,11H2,(H,20,21)