(2-aminocarbonyl-1,3-benzothiazol-6-yl) dihydrogen phosphate; 2-azanyl-2-methyl-propane-1,3-diol

Systemtic Name: (2-aminocarbonyl-1,3-benzothiazol-6-yl) dihydrogen phosphate; 2-azanyl-2-methyl-propane-1,3-diol Openeye Name: 2-amino-2-methyl-propane-1,3-diol; (2-carbamoyl-1,3-benzothiazol-6-yl) dihydrogen phosphate CAS Name: 2-amino-2-methylpropane-1,3-diol; (2-carbamoyl-1,3-benzothiazol-6-yl) dihydrogen phosphate IUPAC Name: 2-amino-2-methylpropane-1,3-diol; (2-carbamoyl-1,3-benzothiazol-6-yl) dihydrogen phosphate Traditional Name: 2-amino-2-methyl-propane-1,3-diol; (2-carbamoyl-1,3-benzothiazol-6-yl) dihydrogen phosphate Formula: C16H29N4O9PS MolecularWeight: 484.461621

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)(CO)N.CC(CO)(CO)N.C1=CC2=C(C=C1OP(=O)(O)O)SC(=N2)C(=O)N

Isomeric SMILES

CC(CO)(CO)N.CC(CO)(CO)N.C1=CC2=C(C=C1OP(=O)(O)O)SC(=N2)C(=O)N

InChI

InChI=1S/C8H7N2O5PS.2C4H11NO2/c9-7(11)8-10-5-2-1-4(3-6(5)17-8)15-16(12,13)14;2*1-4(5,2-6)3-7/h1-3H,(H2,9,11)(H2,12,13,14);2*6-7H,2-3,5H2,1H3