5-[[1-(2-diethylaminoethyl)benzimidazol-2-yl]carbamoyl]-1-methyl-pyrazole-4-carboxylic acid

Systemtic Name: 5-[[1-(2-diethylaminoethyl)benzimidazol-2-yl]carbamoyl]-1-methyl-pyrazole-4-carboxylic acid Openeye Name: 5-[[1-(2-diethylaminoethyl)benzimidazol-2-yl]carbamoyl]-1-methyl-pyrazole-4-carboxylic acid CAS Name: 5-[[[1-(2-diethylaminoethyl)-2-benzimidazolyl]amino]-oxomethyl]-1-methyl-4-pyrazolecarboxylic acid IUPAC Name: 5-[[1-(2-diethylaminoethyl)benzimidazol-2-yl]carbamoyl]-1-methylpyrazole-4-carboxylic acid Traditional Name: 5-[[1-(2-diethylaminoethyl)benzimidazol-2-yl]carbamoyl]-1-methyl-pyrazole-4-carboxylic acid Formula: C19H24N6O3 MolecularWeight: 384.43226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C2=CC=CC=C2N=C1NC(=O)C3=C(C=NN3C)C(=O)O

Isomeric SMILES

CCN(CC)CCN1C2=CC=CC=C2N=C1NC(=O)C3=C(C=NN3C)C(=O)O

InChI

InChI=1S/C19H24N6O3/c1-4-24(5-2)10-11-25-15-9-7-6-8-14(15)21-19(25)22-17(26)16-13(18(27)28)12-20-23(16)3/h6-9,12H,4-5,10-11H2,1-3H3,(H,27,28)(H,21,22,26)