4-[2-(5-chloranyl-6-methyl-2-pyridin-4-yl-pyrimidin-4-yl)hydrazinyl]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: 4-[2-(5-chloranyl-6-methyl-2-pyridin-4-yl-pyrimidin-4-yl)hydrazinyl]-4-oxidanylidene-but-2-enoic acid Openeye Name: 4-[2-[5-chloro-6-methyl-2-(4-pyridyl)pyrimidin-4-yl]hydrazino]-4-oxo-but-2-enoic acid CAS Name: 4-[(5-chloro-6-methyl-2-pyridin-4-yl-4-pyrimidinyl)hydrazo]-4-oxo-2-butenoic acid IUPAC Name: 4-[2-(5-chloro-6-methyl-2-pyridin-4-ylpyrimidin-4-yl)hydrazinyl]-4-oxobut-2-enoic acid Traditional Name: 4-[N'-[5-chloro-6-methyl-2-(4-pyridyl)pyrimidin-4-yl]hydrazino]-4-keto-but-2-enoic acid Formula: C14H12ClN5O3 MolecularWeight: 333.72978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2=CC=NC=C2)NNC(=O)C=CC(=O)O)Cl

Isomeric SMILES

CC1=C(C(=NC(=N1)C2=CC=NC=C2)NNC(=O)C=CC(=O)O)Cl

InChI

InChI=1S/C14H12ClN5O3/c1-8-12(15)14(20-19-10(21)2-3-11(22)23)18-13(17-8)9-4-6-16-7-5-9/h2-7H,1H3,(H,19,21)(H,22,23)(H,17,18,20)