2-[[(2R)-2-(azocan-1-ium-1-yl)propanoyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide

Systemtic Name: 2-[[(2R)-2-(azocan-1-ium-1-yl)propanoyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide Openeye Name: 2-[[(2R)-2-(azocan-1-ium-1-yl)propanoyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide CAS Name: 2-[[(2R)-2-(1-azocan-1-iumyl)-1-oxopropyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide IUPAC Name: 2-[[(2R)-2-(azocan-1-ium-1-yl)propanoyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide Traditional Name: 2-[[(2R)-2-(azocan-1-ium-1-yl)propanoyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide Formula: C18H28N3O2S+ MolecularWeight: 350.49882

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C2=C(S1)CCC2)C(=O)N)[NH+]3CCCCCCC3

Isomeric SMILES

C[C@H](C(=O)NC1=C(C2=C(S1)CCC2)C(=O)N)[NH+]3CCCCCCC3

InChI

InChI=1S/C18H27N3O2S/c1-12(21-10-5-3-2-4-6-11-21)17(23)20-18-15(16(19)22)13-8-7-9-14(13)24-18/h12H,2-11H2,1H3,(H2,19,22)(H,20,23)/p+1/t12-/m1/s1