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

Systemtic Name: 2-(3-phenylpropanoylamino)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide Openeye Name: 2-(3-phenylpropanoylamino)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide CAS Name: 2-[(1-oxo-3-phenylpropyl)amino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide IUPAC Name: 2-(3-phenylpropanoylamino)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide Traditional Name: 2-(hydrocinnamoylamino)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide Formula: C20H24N2O2S MolecularWeight: 356.48176

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC2=C(CC1)C(=C(S2)NC(=O)CCC3=CC=CC=C3)C(=O)N

Isomeric SMILES

C1CCCC2=C(CC1)C(=C(S2)NC(=O)CCC3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C20H24N2O2S/c21-19(24)18-15-10-6-1-2-7-11-16(15)25-20(18)22-17(23)13-12-14-8-4-3-5-9-14/h3-5,8-9H,1-2,6-7,10-13H2,(H2,21,24)(H,22,23)