methanesulfonic acid; 4-(3-morpholin-4-yl-2-phenylsulfanyl-propyl)morpholine

Systemtic Name: methanesulfonic acid; 4-(3-morpholin-4-yl-2-phenylsulfanyl-propyl)morpholine Openeye Name: methanesulfonic acid; 4-(3-morpholino-2-phenylsulfanyl-propyl)morpholine CAS Name: methanesulfonic acid; 4-[3-(4-morpholinyl)-2-(phenylthio)propyl]morpholine IUPAC Name: methanesulfonic acid; 4-(3-morpholin-4-yl-2-phenylsulfanylpropyl)morpholine Traditional Name: mesylic acid; 4-[3-morpholino-2-(phenylthio)propyl]morpholine Formula: C18H30N2O5S2 MolecularWeight: 418.5712

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)O.C1COCCN1CC(CN2CCOCC2)SC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)O.C1COCCN1CC(CN2CCOCC2)SC3=CC=CC=C3

InChI

InChI=1S/C17H26N2O2S.CH4O3S/c1-2-4-16(5-3-1)22-17(14-18-6-10-20-11-7-18)15-19-8-12-21-13-9-19;1-5(2,3)4/h1-5,17H,6-15H2;1H3,(H,2,3,4)