4-butoxy-N-[2-[3-(3,5-dimethylpyrazol-1-yl)propylamino]-2-oxidanylidene-ethyl]benzamide

Systemtic Name: 4-butoxy-N-[2-[3-(3,5-dimethylpyrazol-1-yl)propylamino]-2-oxidanylidene-ethyl]benzamide Openeye Name: 4-butoxy-N-[2-[3-(3,5-dimethylpyrazol-1-yl)propylamino]-2-oxo-ethyl]benzamide CAS Name: 4-butoxy-N-[2-[3-(3,5-dimethyl-1-pyrazolyl)propylamino]-2-oxoethyl]benzamide IUPAC Name: 4-butoxy-N-[2-[3-(3,5-dimethylpyrazol-1-yl)propylamino]-2-oxoethyl]benzamide Traditional Name: 4-butoxy-N-[2-[3-(3,5-dimethylpyrazol-1-yl)propylamino]-2-keto-ethyl]benzamide Formula: C21H30N4O3 MolecularWeight: 386.4879

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NCC(=O)NCCCN2C(=CC(=N2)C)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NCC(=O)NCCCN2C(=CC(=N2)C)C

InChI

InChI=1S/C21H30N4O3/c1-4-5-13-28-19-9-7-18(8-10-19)21(27)23-15-20(26)22-11-6-12-25-17(3)14-16(2)24-25/h7-10,14H,4-6,11-13,15H2,1-3H3,(H,22,26)(H,23,27)