4-azanyl-5-[[6-azanyl-1-[[3-methyl-1-[(4-methylsulfanyl-1-oxidanyl-1-oxidanylidene-butan-2-yl)amino]-1-oxidanylidene-butan-2-yl]amino]-1-oxidanylidene-hexan-2-yl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 4-azanyl-5-[[6-azanyl-1-[[3-methyl-1-[(4-methylsulfanyl-1-oxidanyl-1-oxidanylidene-butan-2-yl)amino]-1-oxidanylidene-butan-2-yl]amino]-1-oxidanylidene-hexan-2-yl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 4-amino-5-[[5-amino-1-[[1-[(1-carboxy-3-methylsulfanyl-propyl)carbamoyl]-2-methyl-propyl]carbamoyl]pentyl]amino]-5-oxo-pentanoic acid CAS Name: 4-amino-5-[[6-amino-1-[[1-[[1-hydroxy-4-(methylthio)-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-1-oxohexan-2-yl]amino]-5-oxopentanoic acid IUPAC Name: 4-amino-5-[[6-amino-1-[[1-[(1-hydroxy-4-methylsulfanyl-1-oxobutan-2-yl)amino]-3-methyl-1-oxobutan-2-yl]amino]-1-oxohexan-2-yl]amino]-5-oxopentanoic acid Traditional Name: 4-amino-5-[[5-amino-1-[[1-[[1-carboxy-3-(methylthio)propyl]carbamoyl]-2-methyl-propyl]carbamoyl]pentyl]amino]-5-keto-valeric acid Formula: C21H39N5O7S MolecularWeight: 505.62866

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(CCSC)C(=O)O)NC(=O)C(CCCCN)NC(=O)C(CCC(=O)O)N

Isomeric SMILES

CC(C)C(C(=O)NC(CCSC)C(=O)O)NC(=O)C(CCCCN)NC(=O)C(CCC(=O)O)N

InChI

InChI=1S/C21H39N5O7S/c1-12(2)17(20(31)25-15(21(32)33)9-11-34-3)26-19(30)14(6-4-5-10-22)24-18(29)13(23)7-8-16(27)28/h12-15,17H,4-11,22-23H2,1-3H3,(H,24,29)(H,25,31)(H,26,30)(H,27,28)(H,32,33)