1-butan-2-yl-2-[(propylcarbamoylamino)methyl]benzimidazole-5-carboxylic acid

Systemtic Name: 1-butan-2-yl-2-[(propylcarbamoylamino)methyl]benzimidazole-5-carboxylic acid Openeye Name: 2-[(propylcarbamoylamino)methyl]-1-sec-butyl-benzimidazole-5-carboxylic acid CAS Name: 1-butan-2-yl-2-[[[oxo(propylamino)methyl]amino]methyl]-5-benzimidazolecarboxylic acid IUPAC Name: 1-butan-2-yl-2-[(propylcarbamoylamino)methyl]benzimidazole-5-carboxylic acid Traditional Name: 2-[(propylcarbamoylamino)methyl]-1-sec-butyl-benzimidazole-5-carboxylic acid Formula: C17H24N4O3 MolecularWeight: 332.39746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NCC1=NC2=C(N1C(C)CC)C=CC(=C2)C(=O)O

Isomeric SMILES

CCCNC(=O)NCC1=NC2=C(N1C(C)CC)C=CC(=C2)C(=O)O

InChI

InChI=1S/C17H24N4O3/c1-4-8-18-17(24)19-10-15-20-13-9-12(16(22)23)6-7-14(13)21(15)11(3)5-2/h6-7,9,11H,4-5,8,10H2,1-3H3,(H,22,23)(H2,18,19,24)