15-[[6-(4-ethylpiperazin-1-yl)pyridin-3-yl]carbonylamino]pentadecyl methanesulfonate

Systemtic Name: 15-[[6-(4-ethylpiperazin-1-yl)pyridin-3-yl]carbonylamino]pentadecyl methanesulfonate Openeye Name: 15-[[6-(4-ethylpiperazin-1-yl)pyridine-3-carbonyl]amino]pentadecyl methanesulfonate CAS Name: methanesulfonic acid 15-[[[6-(4-ethyl-1-piperazinyl)-3-pyridinyl]-oxomethyl]amino]pentadecyl ester IUPAC Name: 15-[[6-(4-ethylpiperazin-1-yl)pyridine-3-carbonyl]amino]pentadecyl methanesulfonate Traditional Name: methanesulfonic acid 15-[[6-(4-ethylpiperazino)nicotinoyl]amino]pentadecyl ester Formula: C28H50N4O4S MolecularWeight: 538.786

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC=C(C=C2)C(=O)NCCCCCCCCCCCCCCCOS(=O)(=O)C

Isomeric SMILES

CCN1CCN(CC1)C2=NC=C(C=C2)C(=O)NCCCCCCCCCCCCCCCOS(=O)(=O)C

InChI

InChI=1S/C28H50N4O4S/c1-3-31-20-22-32(23-21-31)27-18-17-26(25-30-27)28(33)29-19-15-13-11-9-7-5-4-6-8-10-12-14-16-24-36-37(2,34)35/h17-18,25H,3-16,19-24H2,1-2H3,(H,29,33)