2-[2-[[2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylsulfanyl-butanoyl]amino]propanoylamino]-4-methyl-pentanoic acid

Systemtic Name: 2-[2-[[2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylsulfanyl-butanoyl]amino]propanoylamino]-4-methyl-pentanoic acid Openeye Name: 2-[2-[[2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylsulfanyl-butanoyl]amino]propanoylamino]-4-methyl-pentanoic acid CAS Name: 2-[[2-[[2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-4-(methylthio)-1-oxobutyl]amino]-1-oxopropyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[2-[[2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylsulfanylbutanoyl]amino]propanoylamino]-4-methylpentanoic acid Traditional Name: 2-[2-[[2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-(methylthio)butanoyl]amino]propanoylamino]-4-methyl-valeric acid Formula: C29H37N3O6S MolecularWeight: 555.68558

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)C(C)NC(=O)C(CCSC)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13

Isomeric SMILES

CC(C)CC(C(=O)O)NC(=O)C(C)NC(=O)C(CCSC)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13

InChI

InChI=1S/C29H37N3O6S/c1-17(2)15-25(28(35)36)31-26(33)18(3)30-27(34)24(13-14-39-4)32-29(37)38-16-23-21-11-7-5-9-19(21)20-10-6-8-12-22(20)23/h5-12,17-18,23-25H,13-16H2,1-4H3,(H,30,34)(H,31,33)(H,32,37)(H,35,36)