[(2-azanyl-7-ethyl-6-methoxy-1,3-benzothiazol-4-yl)oxy-(2-methylpropanoyloxymethoxy)phosphoryl]oxymethyl 2-methylpropanoate

Systemtic Name: [(2-azanyl-7-ethyl-6-methoxy-1,3-benzothiazol-4-yl)oxy-(2-methylpropanoyloxymethoxy)phosphoryl]oxymethyl 2-methylpropanoate Openeye Name: [(2-amino-7-ethyl-6-methoxy-1,3-benzothiazol-4-yl)oxy-(2-methylpropanoyloxymethoxy)phosphoryl]oxymethyl 2-methylpropanoate CAS Name: 2-methylpropanoic acid [(2-amino-7-ethyl-6-methoxy-1,3-benzothiazol-4-yl)oxy-[(2-methyl-1-oxopropoxy)methoxy]phosphoryl]oxymethyl ester IUPAC Name: [(2-amino-7-ethyl-6-methoxy-1,3-benzothiazol-4-yl)oxy-(2-methylpropanoyloxymethoxy)phosphoryl]oxymethyl 2-methylpropanoate Traditional Name: 2-methylpropionic acid [(2-amino-7-ethyl-6-methoxy-1,3-benzothiazol-4-yl)oxy-(isobutyryloxymethoxy)phosphoryl]oxymethyl ester Formula: C20H29N2O9PS MolecularWeight: 504.491021

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=C(C=C1OC)OP(=O)(OCOC(=O)C(C)C)OCOC(=O)C(C)C)N=C(S2)N

Isomeric SMILES

CCC1=C2C(=C(C=C1OC)OP(=O)(OCOC(=O)C(C)C)OCOC(=O)C(C)C)N=C(S2)N

InChI

InChI=1S/C20H29N2O9PS/c1-7-13-14(26-6)8-15(16-17(13)33-20(21)22-16)31-32(25,29-9-27-18(23)11(2)3)30-10-28-19(24)12(4)5/h8,11-12H,7,9-10H2,1-6H3,(H2,21,22)