1-[2-[[5-azanyl-2-[(2-azanyl-4-methylsulfanyl-butanoyl)amino]-5-oxidanylidene-pentanoyl]amino]-3-oxidanyl-propanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[[5-azanyl-2-[(2-azanyl-4-methylsulfanyl-butanoyl)amino]-5-oxidanylidene-pentanoyl]amino]-3-oxidanyl-propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[[5-amino-2-[(2-amino-4-methylsulfanyl-butanoyl)amino]-5-oxo-pentanoyl]amino]-3-hydroxy-propanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[[5-amino-2-[[2-amino-4-(methylthio)-1-oxobutyl]amino]-1,5-dioxopentyl]amino]-3-hydroxy-1-oxopropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[[5-amino-2-[(2-amino-4-methylsulfanylbutanoyl)amino]-5-oxopentanoyl]amino]-3-hydroxypropanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[[5-amino-2-[[2-amino-4-(methylthio)butanoyl]amino]-5-keto-pentanoyl]amino]-3-hydroxy-propanoyl]proline Formula: C18H31N5O7S MolecularWeight: 461.53304

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC(CCC(=O)N)C(=O)NC(CO)C(=O)N1CCCC1C(=O)O)N

Isomeric SMILES

CSCCC(C(=O)NC(CCC(=O)N)C(=O)NC(CO)C(=O)N1CCCC1C(=O)O)N

InChI

InChI=1S/C18H31N5O7S/c1-31-8-6-10(19)15(26)21-11(4-5-14(20)25)16(27)22-12(9-24)17(28)23-7-2-3-13(23)18(29)30/h10-13,24H,2-9,19H2,1H3,(H2,20,25)(H,21,26)(H,22,27)(H,29,30)