3-[5-(3-methylbutyl)-3-(5-methyl-1,3,4-oxadiazol-2-yl)pyrazol-1-yl]-N-prop-2-ynyl-benzamide

Systemtic Name: 3-[5-(3-methylbutyl)-3-(5-methyl-1,3,4-oxadiazol-2-yl)pyrazol-1-yl]-N-prop-2-ynyl-benzamide Openeye Name: 3-[5-isopentyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)pyrazol-1-yl]-N-prop-2-ynyl-benzamide CAS Name: 3-[5-(3-methylbutyl)-3-(5-methyl-1,3,4-oxadiazol-2-yl)-1-pyrazolyl]-N-prop-2-ynylbenzamide IUPAC Name: 3-[5-(3-methylbutyl)-3-(5-methyl-1,3,4-oxadiazol-2-yl)pyrazol-1-yl]-N-prop-2-ynylbenzamide Traditional Name: 3-[5-isoamyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)pyrazol-1-yl]-N-propargyl-benzamide Formula: C21H23N5O2 MolecularWeight: 377.43962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(O1)C2=NN(C(=C2)CCC(C)C)C3=CC=CC(=C3)C(=O)NCC#C

Isomeric SMILES

CC1=NN=C(O1)C2=NN(C(=C2)CCC(C)C)C3=CC=CC(=C3)C(=O)NCC#C

InChI

InChI=1S/C21H23N5O2/c1-5-11-22-20(27)16-7-6-8-17(12-16)26-18(10-9-14(2)3)13-19(25-26)21-24-23-15(4)28-21/h1,6-8,12-14H,9-11H2,2-4H3,(H,22,27)