1-[3-[[(1S)-1-(1,3-dimethylpyrazol-4-yl)ethyl]amino]-3-oxidanylidene-propyl]pyrazole-3-carboxylate

Systemtic Name: 1-[3-[[(1S)-1-(1,3-dimethylpyrazol-4-yl)ethyl]amino]-3-oxidanylidene-propyl]pyrazole-3-carboxylate Openeye Name: 1-[3-[[(1S)-1-(1,3-dimethylpyrazol-4-yl)ethyl]amino]-3-oxo-propyl]pyrazole-3-carboxylate CAS Name: 1-[3-[[(1S)-1-(1,3-dimethyl-4-pyrazolyl)ethyl]amino]-3-oxopropyl]-3-pyrazolecarboxylate IUPAC Name: 1-[3-[[(1S)-1-(1,3-dimethylpyrazol-4-yl)ethyl]amino]-3-oxopropyl]pyrazole-3-carboxylate Traditional Name: 1-[3-[[(1S)-1-(1,3-dimethylpyrazol-4-yl)ethyl]amino]-3-keto-propyl]pyrazole-3-carboxylate Formula: C14H18N5O3- MolecularWeight: 304.32442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C(C)NC(=O)CCN2C=CC(=N2)C(=O)[O-])C

Isomeric SMILES

CC1=NN(C=C1[C@H](C)NC(=O)CCN2C=CC(=N2)C(=O)[O-])C

InChI

InChI=1S/C14H19N5O3/c1-9(11-8-18(3)16-10(11)2)15-13(20)5-7-19-6-4-12(17-19)14(21)22/h4,6,8-9H,5,7H2,1-3H3,(H,15,20)(H,21,22)/p-1/t9-/m0/s1