3-[1,1-bis(oxidanylidene)thian-4-yl]-1-(2-chloroethyl)-1-nitroso-urea

Systemtic Name: 3-[1,1-bis(oxidanylidene)thian-4-yl]-1-(2-chloroethyl)-1-nitroso-urea Openeye Name: 1-(2-chloroethyl)-3-(1,1-dioxothian-4-yl)-1-nitroso-urea CAS Name: 1-(2-chloroethyl)-3-(1,1-dioxo-4-thianyl)-1-nitrosourea IUPAC Name: 1-(2-chloroethyl)-3-(1,1-dioxothian-4-yl)-1-nitrosourea Traditional Name: 1-(2-chloroethyl)-3-(1,1-diketothian-4-yl)-1-nitroso-urea Formula: C8H14ClN3O4S MolecularWeight: 283.73246

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CCC1NC(=O)N(CCCl)N=O

Isomeric SMILES

C1CS(=O)(=O)CCC1NC(=O)N(CCCl)N=O

InChI

InChI=1S/C8H14ClN3O4S/c9-3-4-12(11-14)8(13)10-7-1-5-17(15,16)6-2-7/h7H,1-6H2,(H,10,13)