1-[1,1-bis(oxidanylidene)thiolan-3-yl]-3-(2-chloroethyl)-1-nitroso-urea

Systemtic Name: 1-[1,1-bis(oxidanylidene)thiolan-3-yl]-3-(2-chloroethyl)-1-nitroso-urea Openeye Name: 3-(2-chloroethyl)-1-(1,1-dioxothiolan-3-yl)-1-nitroso-urea CAS Name: 3-(2-chloroethyl)-1-(1,1-dioxo-3-thiolanyl)-1-nitrosourea IUPAC Name: 3-(2-chloroethyl)-1-(1,1-dioxothiolan-3-yl)-1-nitrosourea Traditional Name: 3-(2-chloroethyl)-1-(1,1-diketothiolan-3-yl)-1-nitroso-urea Formula: C7H12ClN3O4S MolecularWeight: 269.70588

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1N(C(=O)NCCCl)N=O

Isomeric SMILES

C1CS(=O)(=O)CC1N(C(=O)NCCCl)N=O

InChI

InChI=1S/C7H12ClN3O4S/c8-2-3-9-7(12)11(10-13)6-1-4-16(14,15)5-6/h6H,1-5H2,(H,9,12)