9H-fluoren-9-ylmethyl 2-[[2-[(2-azanyl-4-methylsulfanyl-butanoyl)amino]-4-methyl-pentanoyl]amino]-3-phenyl-propanoate

Systemtic Name: 9H-fluoren-9-ylmethyl 2-[[2-[(2-azanyl-4-methylsulfanyl-butanoyl)amino]-4-methyl-pentanoyl]amino]-3-phenyl-propanoate Openeye Name: 9H-fluoren-9-ylmethyl 2-[[2-[(2-amino-4-methylsulfanyl-butanoyl)amino]-4-methyl-pentanoyl]amino]-3-phenyl-propanoate CAS Name: 2-[[2-[[2-amino-4-(methylthio)-1-oxobutyl]amino]-4-methyl-1-oxopentyl]amino]-3-phenylpropanoic acid 9H-fluoren-9-ylmethyl ester IUPAC Name: 9H-fluoren-9-ylmethyl 2-[[2-[(2-amino-4-methylsulfanylbutanoyl)amino]-4-methylpentanoyl]amino]-3-phenylpropanoate Traditional Name: 2-[[2-[[2-amino-4-(methylthio)butanoyl]amino]-4-methyl-pentanoyl]amino]-3-phenyl-propionic acid 9H-fluoren-9-ylmethyl ester Formula: C34H41N3O4S MolecularWeight: 587.77204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC1=CC=CC=C1)C(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)NC(=O)C(CCSC)N

Isomeric SMILES

CC(C)CC(C(=O)NC(CC1=CC=CC=C1)C(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)NC(=O)C(CCSC)N

InChI

InChI=1S/C34H41N3O4S/c1-22(2)19-30(36-32(38)29(35)17-18-42-3)33(39)37-31(20-23-11-5-4-6-12-23)34(40)41-21-28-26-15-9-7-13-24(26)25-14-8-10-16-27(25)28/h4-16,22,28-31H,17-21,35H2,1-3H3,(H,36,38)(H,37,39)