2-azanyl-3-[2-[[2-chloroethyl(nitroso)carbamoyl]amino]ethylsulfanyl]propanoic acid

Systemtic Name: 2-azanyl-3-[2-[[2-chloroethyl(nitroso)carbamoyl]amino]ethylsulfanyl]propanoic acid Openeye Name: 2-amino-3-[2-[[2-chloroethyl(nitroso)carbamoyl]amino]ethylsulfanyl]propanoic acid CAS Name: 2-amino-3-[2-[[[2-chloroethyl(nitroso)amino]-oxomethyl]amino]ethylthio]propanoic acid IUPAC Name: 2-amino-3-[2-[[2-chloroethyl(nitroso)carbamoyl]amino]ethylsulfanyl]propanoic acid Traditional Name: 2-amino-3-[2-[[2-chloroethyl(nitroso)carbamoyl]amino]ethylthio]propionic acid Formula: C8H15ClN4O4S MolecularWeight: 298.7471

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Descriptors Computed from Structure

Canonical SMILES:

C(CSCC(C(=O)O)N)NC(=O)N(CCCl)N=O

Isomeric SMILES

C(CSCC(C(=O)O)N)NC(=O)N(CCCl)N=O

InChI

InChI=1S/C8H15ClN4O4S/c9-1-3-13(12-17)8(16)11-2-4-18-5-6(10)7(14)15/h6H,1-5,10H2,(H,11,16)(H,14,15)