5-[(2-methylbutylcarbamoylamino)methyl]thiophene-2-carboxylic acid

Systemtic Name: 5-[(2-methylbutylcarbamoylamino)methyl]thiophene-2-carboxylic acid Openeye Name: 5-[(2-methylbutylcarbamoylamino)methyl]thiophene-2-carboxylic acid CAS Name: 5-[[[(2-methylbutylamino)-oxomethyl]amino]methyl]-2-thiophenecarboxylic acid IUPAC Name: 5-[(2-methylbutylcarbamoylamino)methyl]thiophene-2-carboxylic acid Traditional Name: 5-[(2-methylbutylcarbamoylamino)methyl]-2-thenoic acid Formula: C12H18N2O3S MolecularWeight: 270.34792

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CNC(=O)NCC1=CC=C(S1)C(=O)O

Isomeric SMILES

CCC(C)CNC(=O)NCC1=CC=C(S1)C(=O)O

InChI

InChI=1S/C12H18N2O3S/c1-3-8(2)6-13-12(17)14-7-9-4-5-10(18-9)11(15)16/h4-5,8H,3,6-7H2,1-2H3,(H,15,16)(H2,13,14,17)