4-chloranyl-3-[4-[(4-methoxyphenyl)methylamino]pyrimidin-2-yl]-5-propyl-pyrazole-4-carbaldehyde

Systemtic Name: 4-chloranyl-3-[4-[(4-methoxyphenyl)methylamino]pyrimidin-2-yl]-5-propyl-pyrazole-4-carbaldehyde Openeye Name: 4-chloro-3-[4-[(4-methoxyphenyl)methylamino]pyrimidin-2-yl]-5-propyl-pyrazole-4-carbaldehyde CAS Name: 4-chloro-3-[4-[(4-methoxyphenyl)methylamino]-2-pyrimidinyl]-5-propyl-4-pyrazolecarboxaldehyde IUPAC Name: 4-chloro-3-[4-[(4-methoxyphenyl)methylamino]pyrimidin-2-yl]-5-propylpyrazole-4-carbaldehyde Traditional Name: 4-chloro-3-[4-(p-anisylamino)pyrimidin-2-yl]-5-propyl-pyrazole-4-carbaldehyde Formula: C19H20ClN5O2 MolecularWeight: 385.8474

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(C1(C=O)Cl)C2=NC=CC(=N2)NCC3=CC=C(C=C3)OC

Isomeric SMILES

CCCC1=NN=C(C1(C=O)Cl)C2=NC=CC(=N2)NCC3=CC=C(C=C3)OC

InChI

InChI=1S/C19H20ClN5O2/c1-3-4-15-19(20,12-26)17(25-24-15)18-21-10-9-16(23-18)22-11-13-5-7-14(27-2)8-6-13/h5-10,12H,3-4,11H2,1-2H3,(H,21,22,23)