methyl (2S)-2-[(4-formamido-1,2-dithiolan-4-yl)carbonylamino]-4-methyl-pentanoate

Systemtic Name: methyl (2S)-2-[(4-formamido-1,2-dithiolan-4-yl)carbonylamino]-4-methyl-pentanoate Openeye Name: methyl (2S)-2-[(4-formamidodithiolane-4-carbonyl)amino]-4-methyl-pentanoate CAS Name: (2S)-2-[[(4-formamido-4-dithiolanyl)-oxomethyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(4-formamidodithiolane-4-carbonyl)amino]-4-methylpentanoate Traditional Name: (2S)-2-[(4-formamidodithiolane-4-carbonyl)amino]-4-methyl-valeric acid methyl ester Formula: C12H20N2O4S2 MolecularWeight: 320.4282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)C1(CSSC1)NC=O

Isomeric SMILES

CC(C)C[C@@H](C(=O)OC)NC(=O)C1(CSSC1)NC=O

InChI

InChI=1S/C12H20N2O4S2/c1-8(2)4-9(10(16)18-3)14-11(17)12(13-7-15)5-19-20-6-12/h7-9H,4-6H2,1-3H3,(H,13,15)(H,14,17)/t9-/m0/s1