2-[3-[[1-ethyl-3-(propan-2-ylcarbamoyl)pyrazol-4-yl]amino]-3-oxidanylidene-propyl]pyrazole-3-carboxylic acid

Systemtic Name: 2-[3-[[1-ethyl-3-(propan-2-ylcarbamoyl)pyrazol-4-yl]amino]-3-oxidanylidene-propyl]pyrazole-3-carboxylic acid Openeye Name: 2-[3-[[1-ethyl-3-(isopropylcarbamoyl)pyrazol-4-yl]amino]-3-oxo-propyl]pyrazole-3-carboxylic acid CAS Name: 2-[3-[[1-ethyl-3-[oxo-(propan-2-ylamino)methyl]-4-pyrazolyl]amino]-3-oxopropyl]-3-pyrazolecarboxylic acid IUPAC Name: 2-[3-[[1-ethyl-3-(propan-2-ylcarbamoyl)pyrazol-4-yl]amino]-3-oxopropyl]pyrazole-3-carboxylic acid Traditional Name: 2-[3-[[1-ethyl-3-(isopropylcarbamoyl)pyrazol-4-yl]amino]-3-keto-propyl]pyrazole-3-carboxylic acid Formula: C16H22N6O4 MolecularWeight: 362.38368

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NC(C)C)NC(=O)CCN2C(=CC=N2)C(=O)O

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NC(C)C)NC(=O)CCN2C(=CC=N2)C(=O)O

InChI

InChI=1S/C16H22N6O4/c1-4-21-9-11(14(20-21)15(24)18-10(2)3)19-13(23)6-8-22-12(16(25)26)5-7-17-22/h5,7,9-10H,4,6,8H2,1-3H3,(H,18,24)(H,19,23)(H,25,26)