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

Systemtic Name: 15-[[6-(4-methylpiperazin-1-yl)pyridin-3-yl]carbonylamino]pentadecyl methanesulfonate Openeye Name: 15-[[6-(4-methylpiperazin-1-yl)pyridine-3-carbonyl]amino]pentadecyl methanesulfonate CAS Name: methanesulfonic acid 15-[[[6-(4-methyl-1-piperazinyl)-3-pyridinyl]-oxomethyl]amino]pentadecyl ester IUPAC Name: 15-[[6-(4-methylpiperazin-1-yl)pyridine-3-carbonyl]amino]pentadecyl methanesulfonate Traditional Name: methanesulfonic acid 15-[[6-(4-methylpiperazino)nicotinoyl]amino]pentadecyl ester Formula: C27H48N4O4S MolecularWeight: 524.75942

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC=C(C=C2)C(=O)NCCCCCCCCCCCCCCCOS(=O)(=O)C

Isomeric SMILES

CN1CCN(CC1)C2=NC=C(C=C2)C(=O)NCCCCCCCCCCCCCCCOS(=O)(=O)C

InChI

InChI=1S/C27H48N4O4S/c1-30-19-21-31(22-20-30)26-17-16-25(24-29-26)27(32)28-18-14-12-10-8-6-4-3-5-7-9-11-13-15-23-35-36(2,33)34/h16-17,24H,3-15,18-23H2,1-2H3,(H,28,32)