2-sulfooxyethyl 3-[(4-chloranyl-6-methyl-1,3,5-triazin-2-yl)-methyl-amino]propane-1-sulfinate

Systemtic Name: 2-sulfooxyethyl 3-[(4-chloranyl-6-methyl-1,3,5-triazin-2-yl)-methyl-amino]propane-1-sulfinate Openeye Name: 2-sulfooxyethyl 3-[(4-chloro-6-methyl-1,3,5-triazin-2-yl)-methyl-amino]propane-1-sulfinate CAS Name: 3-[(4-chloro-6-methyl-1,3,5-triazin-2-yl)-methylamino]-1-propanesulfinic acid IUPAC Name: 2-sulfooxyethyl 3-[(4-chloro-6-methyl-1,3,5-triazin-2-yl)-methylamino]propane-1-sulfinate Traditional Name: 3-[(4-chloro-6-methyl-s-triazin-2-yl)-methyl-amino]propane-1-sulfinic acid 2-sulfoxyethyl ester Formula: C10H17ClN4O6S2 MolecularWeight: 388.84818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=N1)Cl)N(C)CCCS(=O)OCCOS(=O)(=O)O

Isomeric SMILES

CC1=NC(=NC(=N1)Cl)N(C)CCCS(=O)OCCOS(=O)(=O)O

InChI

InChI=1S/C10H17ClN4O6S2/c1-8-12-9(11)14-10(13-8)15(2)4-3-7-22(16)20-5-6-21-23(17,18)19/h3-7H2,1-2H3,(H,17,18,19)