5-chloranyl-3-methyl-1-(phenylmethyl)-N-prop-2-ynyl-pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-3-methyl-1-(phenylmethyl)-N-prop-2-ynyl-pyrazole-4-carboxamide Openeye Name: 1-benzyl-5-chloro-3-methyl-N-prop-2-ynyl-pyrazole-4-carboxamide CAS Name: 5-chloro-3-methyl-1-(phenylmethyl)-N-prop-2-ynyl-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-5-chloro-3-methyl-N-prop-2-ynylpyrazole-4-carboxamide Traditional Name: 1-benzyl-5-chloro-3-methyl-N-propargyl-pyrazole-4-carboxamide Formula: C15H14ClN3O MolecularWeight: 287.74416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NCC#C)Cl)CC2=CC=CC=C2

Isomeric SMILES

CC1=NN(C(=C1C(=O)NCC#C)Cl)CC2=CC=CC=C2

InChI

InChI=1S/C15H14ClN3O/c1-3-9-17-15(20)13-11(2)18-19(14(13)16)10-12-7-5-4-6-8-12/h1,4-8H,9-10H2,2H3,(H,17,20)