5-(dipropylamino)-4-[[2-(1,3-dithiol-2-ylidene)-3-oxidanyl-3-oxidanylidene-propanoyl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-(dipropylamino)-4-[[2-(1,3-dithiol-2-ylidene)-3-oxidanyl-3-oxidanylidene-propanoyl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-(dipropylamino)-4-[[2-(1,3-dithiol-2-ylidene)-3-hydroxy-3-oxo-propanoyl]amino]-5-oxo-pentanoic acid CAS Name: 5-(dipropylamino)-4-[[2-(1,3-dithiol-2-ylidene)-3-hydroxy-1,3-dioxopropyl]amino]-5-oxopentanoic acid IUPAC Name: 5-(dipropylamino)-4-[[2-(1,3-dithiol-2-ylidene)-3-hydroxy-3-oxopropanoyl]amino]-5-oxopentanoic acid Traditional Name: 5-(dipropylamino)-4-[[2-(1,3-dithiol-2-ylidene)-3-hydroxy-3-keto-propanoyl]amino]-5-keto-valeric acid Formula: C17H24N2O6S2 MolecularWeight: 416.51226

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)C(CCC(=O)O)NC(=O)C(=C1SC=CS1)C(=O)O

Isomeric SMILES

CCCN(CCC)C(=O)C(CCC(=O)O)NC(=O)C(=C1SC=CS1)C(=O)O

InChI

InChI=1S/C17H24N2O6S2/c1-3-7-19(8-4-2)15(23)11(5-6-12(20)21)18-14(22)13(16(24)25)17-26-9-10-27-17/h9-11H,3-8H2,1-2H3,(H,18,22)(H,20,21)(H,24,25)