2-[[(2R)-2-(azepan-1-ium-1-yl)propanoyl]amino]thiophene-3-carboxamide

Systemtic Name: 2-[[(2R)-2-(azepan-1-ium-1-yl)propanoyl]amino]thiophene-3-carboxamide Openeye Name: 2-[[(2R)-2-(azepan-1-ium-1-yl)propanoyl]amino]thiophene-3-carboxamide CAS Name: 2-[[(2R)-2-(1-azepan-1-iumyl)-1-oxopropyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[[(2R)-2-(azepan-1-ium-1-yl)propanoyl]amino]thiophene-3-carboxamide Traditional Name: 2-[[(2R)-2-(azepan-1-ium-1-yl)propanoyl]amino]thiophene-3-carboxamide Formula: C14H22N3O2S+ MolecularWeight: 296.40838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CS1)C(=O)N)[NH+]2CCCCCC2

Isomeric SMILES

C[C@H](C(=O)NC1=C(C=CS1)C(=O)N)[NH+]2CCCCCC2

InChI

InChI=1S/C14H21N3O2S/c1-10(17-7-4-2-3-5-8-17)13(19)16-14-11(12(15)18)6-9-20-14/h6,9-10H,2-5,7-8H2,1H3,(H2,15,18)(H,16,19)/p+1/t10-/m1/s1