[6-azanyl-2-azanylidene-4-(4-methylphenyl)sulfonyloxy-pyrimidin-1-yl] ethanoate

Systemtic Name: [6-azanyl-2-azanylidene-4-(4-methylphenyl)sulfonyloxy-pyrimidin-1-yl] ethanoate Openeye Name: [6-amino-2-imino-4-(p-tolylsulfonyloxy)pyrimidin-1-yl] acetate CAS Name: acetic acid [6-amino-2-imino-4-(4-methylphenyl)sulfonyloxy-1-pyrimidinyl] ester IUPAC Name: [6-amino-2-imino-4-(4-methylphenyl)sulfonyloxypyrimidin-1-yl] acetate Traditional Name: acetic acid (6-amino-2-imino-4-tosyloxy-pyrimidin-1-yl) ester Formula: C13H14N4O5S MolecularWeight: 338.33906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=NC(=N)N(C(=C2)N)OC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=NC(=N)N(C(=C2)N)OC(=O)C

InChI

InChI=1S/C13H14N4O5S/c1-8-3-5-10(6-4-8)23(19,20)22-12-7-11(14)17(13(15)16-12)21-9(2)18/h3-7,15H,14H2,1-2H3