3-(2-chloroethyl)-1-(2-methylsulfonylethyl)-1-nitroso-urea

Systemtic Name: 3-(2-chloroethyl)-1-(2-methylsulfonylethyl)-1-nitroso-urea Openeye Name: 3-(2-chloroethyl)-1-(2-methylsulfonylethyl)-1-nitroso-urea CAS Name: 3-(2-chloroethyl)-1-(2-methylsulfonylethyl)-1-nitrosourea IUPAC Name: 3-(2-chloroethyl)-1-(2-methylsulfonylethyl)-1-nitrosourea Traditional Name: 3-(2-chloroethyl)-1-(2-mesylethyl)-1-nitroso-urea Formula: C6H12ClN3O4S MolecularWeight: 257.69518

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCN(C(=O)NCCCl)N=O

Isomeric SMILES

CS(=O)(=O)CCN(C(=O)NCCCl)N=O

InChI

InChI=1S/C6H12ClN3O4S/c1-15(13,14)5-4-10(9-12)6(11)8-3-2-7/h2-5H2,1H3,(H,8,11)