3-(2-azanylpentanoylamino)-3-thiophen-2-yl-propanoic acid

Systemtic Name: 3-(2-azanylpentanoylamino)-3-thiophen-2-yl-propanoic acid Openeye Name: 3-(2-aminopentanoylamino)-3-(2-thienyl)propanoic acid CAS Name: 3-[(2-amino-1-oxopentyl)amino]-3-thiophen-2-ylpropanoic acid IUPAC Name: 3-(2-aminopentanoylamino)-3-thiophen-2-ylpropanoic acid Traditional Name: 3-(2-aminopentanoylamino)-3-(2-thienyl)propionic acid Formula: C12H18N2O3S MolecularWeight: 270.34792

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NC(CC(=O)O)C1=CC=CS1)N

Isomeric SMILES

CCCC(C(=O)NC(CC(=O)O)C1=CC=CS1)N

InChI

InChI=1S/C12H18N2O3S/c1-2-4-8(13)12(17)14-9(7-11(15)16)10-5-3-6-18-10/h3,5-6,8-9H,2,4,7,13H2,1H3,(H,14,17)(H,15,16)