1-(2-chloroethyl)-1-nitroso-3-(5-nitro-1,3-thiazol-2-yl)urea

Systemtic Name: 1-(2-chloroethyl)-1-nitroso-3-(5-nitro-1,3-thiazol-2-yl)urea Openeye Name: 1-(2-chloroethyl)-1-nitroso-3-(5-nitrothiazol-2-yl)urea CAS Name: 1-(2-chloroethyl)-1-nitroso-3-(5-nitro-2-thiazolyl)urea IUPAC Name: 1-(2-chloroethyl)-1-nitroso-3-(5-nitro-1,3-thiazol-2-yl)urea Traditional Name: 1-(2-chloroethyl)-1-nitroso-3-(5-nitrothiazol-2-yl)urea Formula: C6H6ClN5O4S MolecularWeight: 279.66094

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=N1)NC(=O)N(CCCl)N=O)[N+](=O)[O-]

Isomeric SMILES

C1=C(SC(=N1)NC(=O)N(CCCl)N=O)[N+](=O)[O-]

InChI

InChI=1S/C6H6ClN5O4S/c7-1-2-11(10-14)6(13)9-5-8-3-4(17-5)12(15)16/h3H,1-2H2,(H,8,9,13)