2,2,2-tris(chloranyl)ethyl N-[(4-methoxypteridin-2-yl)carbamoyl]sulfamate

Systemtic Name: 2,2,2-tris(chloranyl)ethyl N-[(4-methoxypteridin-2-yl)carbamoyl]sulfamate Openeye Name: 2,2,2-trichloroethyl N-[(4-methoxypteridin-2-yl)carbamoyl]sulfamate CAS Name: N-[[(4-methoxy-2-pteridinyl)amino]-oxomethyl]sulfamic acid 2,2,2-trichloroethyl ester IUPAC Name: 2,2,2-trichloroethyl N-[(4-methoxypteridin-2-yl)carbamoyl]sulfamate Traditional Name: N-[(4-methoxypteridin-2-yl)carbamoyl]sulfamic acid 2,2,2-trichloroethyl ester Formula: C10H9Cl3N6O5S MolecularWeight: 431.63966

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC2=NC=CN=C21)NC(=O)NS(=O)(=O)OCC(Cl)(Cl)Cl

Isomeric SMILES

COC1=NC(=NC2=NC=CN=C21)NC(=O)NS(=O)(=O)OCC(Cl)(Cl)Cl

InChI

InChI=1S/C10H9Cl3N6O5S/c1-23-7-5-6(15-3-2-14-5)16-8(17-7)18-9(20)19-25(21,22)24-4-10(11,12)13/h2-3H,4H2,1H3,(H2,15,16,17,18,19,20)