methyl 3-(4-azanylbutanoylamino)-3-thiophen-2-yl-propanoate

Systemtic Name: methyl 3-(4-azanylbutanoylamino)-3-thiophen-2-yl-propanoate Openeye Name: methyl 3-(4-aminobutanoylamino)-3-(2-thienyl)propanoate CAS Name: 3-[(4-amino-1-oxobutyl)amino]-3-thiophen-2-ylpropanoic acid methyl ester IUPAC Name: methyl 3-(4-aminobutanoylamino)-3-thiophen-2-ylpropanoate Traditional Name: 3-(4-aminobutanoylamino)-3-(2-thienyl)propionic acid methyl ester Formula: C12H18N2O3S MolecularWeight: 270.34792

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CS1)NC(=O)CCCN

Isomeric SMILES

COC(=O)CC(C1=CC=CS1)NC(=O)CCCN

InChI

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