methanesulfonic acid; 4-(1-morpholin-4-yl-3-phenylsulfanyl-propan-2-yl)morpholine

Systemtic Name: methanesulfonic acid; 4-(1-morpholin-4-yl-3-phenylsulfanyl-propan-2-yl)morpholine Openeye Name: methanesulfonic acid; 4-[1-(morpholinomethyl)-2-phenylsulfanyl-ethyl]morpholine CAS Name: methanesulfonic acid; 4-[1-(4-morpholinyl)-3-(phenylthio)propan-2-yl]morpholine IUPAC Name: methanesulfonic acid; 4-(1-morpholin-4-yl-3-phenylsulfanylpropan-2-yl)morpholine Traditional Name: mesylic acid; 4-[1-(morpholinomethyl)-2-(phenylthio)ethyl]morpholine Formula: C18H30N2O5S2 MolecularWeight: 418.5712

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)O.C1COCCN1CC(CSC2=CC=CC=C2)N3CCOCC3

Isomeric SMILES

CS(=O)(=O)O.C1COCCN1CC(CSC2=CC=CC=C2)N3CCOCC3

InChI

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