N-(3-ethylpent-1-yn-3-yl)-2-[4-[(5-fluoranyl-2-methoxy-phenyl)methyl]piperazin-1-yl]ethanamide

Systemtic Name: N-(3-ethylpent-1-yn-3-yl)-2-[4-[(5-fluoranyl-2-methoxy-phenyl)methyl]piperazin-1-yl]ethanamide Openeye Name: N-(1,1-diethylprop-2-ynyl)-2-[4-[(5-fluoro-2-methoxy-phenyl)methyl]piperazin-1-yl]acetamide CAS Name: N-(3-ethylpent-1-yn-3-yl)-2-[4-[(5-fluoro-2-methoxyphenyl)methyl]-1-piperazinyl]acetamide IUPAC Name: N-(3-ethylpent-1-yn-3-yl)-2-[4-[(5-fluoro-2-methoxyphenyl)methyl]piperazin-1-yl]acetamide Traditional Name: N-(1,1-diethylprop-2-ynyl)-2-[4-(5-fluoro-2-methoxy-benzyl)piperazino]acetamide Formula: C21H30FN3O2 MolecularWeight: 375.480203

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C#C)NC(=O)CN1CCN(CC1)CC2=C(C=CC(=C2)F)OC

Isomeric SMILES

CCC(CC)(C#C)NC(=O)CN1CCN(CC1)CC2=C(C=CC(=C2)F)OC

InChI

InChI=1S/C21H30FN3O2/c1-5-21(6-2,7-3)23-20(26)16-25-12-10-24(11-13-25)15-17-14-18(22)8-9-19(17)27-4/h1,8-9,14H,6-7,10-13,15-16H2,2-4H3,(H,23,26)