5-[[3-(dibutylamino)propylcarbamoylamino]methyl]thiophene-2-carboxylic acid

Systemtic Name: 5-[[3-(dibutylamino)propylcarbamoylamino]methyl]thiophene-2-carboxylic acid Openeye Name: 5-[[3-(dibutylamino)propylcarbamoylamino]methyl]thiophene-2-carboxylic acid CAS Name: 5-[[[[3-(dibutylamino)propylamino]-oxomethyl]amino]methyl]-2-thiophenecarboxylic acid IUPAC Name: 5-[[3-(dibutylamino)propylcarbamoylamino]methyl]thiophene-2-carboxylic acid Traditional Name: 5-[[3-(dibutylamino)propylcarbamoylamino]methyl]-2-thenoic acid Formula: C18H31N3O3S MolecularWeight: 369.52204

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CCCNC(=O)NCC1=CC=C(S1)C(=O)O

Isomeric SMILES

CCCCN(CCCC)CCCNC(=O)NCC1=CC=C(S1)C(=O)O

InChI

InChI=1S/C18H31N3O3S/c1-3-5-11-21(12-6-4-2)13-7-10-19-18(24)20-14-15-8-9-16(25-15)17(22)23/h8-9H,3-7,10-14H2,1-2H3,(H,22,23)(H2,19,20,24)