ethyl (2S)-2-[[(Z)-3-nitrosobut-2-en-2-yl]amino]-3-sulfanyl-propanoate

Systemtic Name: ethyl (2S)-2-[[(Z)-3-nitrosobut-2-en-2-yl]amino]-3-sulfanyl-propanoate Openeye Name: ethyl (2S)-2-[[(Z)-1-methyl-2-nitroso-prop-1-enyl]amino]-3-sulfanyl-propanoate CAS Name: (2S)-3-mercapto-2-[[(Z)-3-nitrosobut-2-en-2-yl]amino]propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-[[(Z)-3-nitrosobut-2-en-2-yl]amino]-3-sulfanylpropanoate Traditional Name: (2S)-3-mercapto-2-[[(Z)-1-methyl-2-nitroso-prop-1-enyl]amino]propionic acid ethyl ester Formula: C9H16N2O3S MolecularWeight: 232.29994

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CS)NC(=C(C)N=O)C

Isomeric SMILES

CCOC(=O)[C@@H](CS)N/C(=C(/C)\N=O)/C

InChI

InChI=1S/C9H16N2O3S/c1-4-14-9(12)8(5-15)10-6(2)7(3)11-13/h8,10,15H,4-5H2,1-3H3/b7-6-/t8-/m1/s1