N-carbamimidoyl-5-ethyl-N-quinolin-2-yl-1H-pyrazole-4-carboxamide dihydrochloride

Systemtic Name: N-carbamimidoyl-5-ethyl-N-quinolin-2-yl-1H-pyrazole-4-carboxamide dihydrochloride Openeye Name: N-carbamimidoyl-5-ethyl-N-(2-quinolyl)-1H-pyrazole-4-carboxamide dihydrochloride CAS Name: N-carbamimidoyl-5-ethyl-N-(2-quinolinyl)-1H-pyrazole-4-carboxamide dihydrochloride IUPAC Name: N-carbamimidoyl-5-ethyl-N-quinolin-2-yl-1H-pyrazole-4-carboxamide dihydrochloride Traditional Name: N-amidino-5-ethyl-N-(2-quinolyl)-1H-pyrazole-4-carboxamide dihydrochloride Formula: C16H18Cl2N6O MolecularWeight: 381.25972

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=NN1)C(=O)N(C2=NC3=CC=CC=C3C=C2)C(=N)N.Cl.Cl

Isomeric SMILES

CCC1=C(C=NN1)C(=O)N(C2=NC3=CC=CC=C3C=C2)C(=N)N.Cl.Cl

InChI

InChI=1S/C16H16N6O.2ClH/c1-2-12-11(9-19-21-12)15(23)22(16(17)18)14-8-7-10-5-3-4-6-13(10)20-14;;/h3-9H,2H2,1H3,(H3,17,18)(H,19,21);2*1H