2-[2-(azepan-1-ium-1-yl)ethanoylamino]thiophene-3-carboxamide

Systemtic Name: 2-[2-(azepan-1-ium-1-yl)ethanoylamino]thiophene-3-carboxamide Openeye Name: 2-[[2-(azepan-1-ium-1-yl)acetyl]amino]thiophene-3-carboxamide CAS Name: 2-[[2-(1-azepan-1-iumyl)-1-oxoethyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[[2-(azepan-1-ium-1-yl)acetyl]amino]thiophene-3-carboxamide Traditional Name: 2-[[2-(azepan-1-ium-1-yl)acetyl]amino]thiophene-3-carboxamide Formula: C13H20N3O2S+ MolecularWeight: 282.3818

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)CC(=O)NC2=C(C=CS2)C(=O)N

Isomeric SMILES

C1CCC[NH+](CC1)CC(=O)NC2=C(C=CS2)C(=O)N

InChI

InChI=1S/C13H19N3O2S/c14-12(18)10-5-8-19-13(10)15-11(17)9-16-6-3-1-2-4-7-16/h5,8H,1-4,6-7,9H2,(H2,14,18)(H,15,17)/p+1