methyl (2S)-2-[[2-chloroethyl(nitroso)carbamoyl]amino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl (2S)-2-[[2-chloroethyl(nitroso)carbamoyl]amino]-4-methylsulfanyl-butanoate Openeye Name: methyl (2S)-2-[[2-chloroethyl(nitroso)carbamoyl]amino]-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[[2-chloroethyl(nitroso)amino]-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[2-chloroethyl(nitroso)carbamoyl]amino]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[[2-chloroethyl(nitroso)carbamoyl]amino]-4-(methylthio)butyric acid methyl ester Formula: C9H16ClN3O4S MolecularWeight: 297.75904

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCSC)NC(=O)N(CCCl)N=O

Isomeric SMILES

COC(=O)[C@H](CCSC)NC(=O)N(CCCl)N=O

InChI

InChI=1S/C9H16ClN3O4S/c1-17-8(14)7(3-6-18-2)11-9(15)13(12-16)5-4-10/h7H,3-6H2,1-2H3,(H,11,15)/t7-/m0/s1