disodium 4-methyl-2-[[2-[[methyl(oxidanidyl)phosphinothioyl]amino]-3-phenyl-propanoyl]amino]pentanoate

Systemtic Name: disodium 4-methyl-2-[[2-[[methyl(oxidanidyl)phosphinothioyl]amino]-3-phenyl-propanoyl]amino]pentanoate Openeye Name: disodium 4-methyl-2-[[2-[[methyl(oxido)phosphinothioyl]amino]-3-phenyl-propanoyl]amino]pentanoate CAS Name: disodium 4-methyl-2-[[2-[[methyl(oxido)phosphinothioyl]amino]-1-oxo-3-phenylpropyl]amino]pentanoate IUPAC Name: disodium 4-methyl-2-[[2-[[methyl(oxido)phosphinothioyl]amino]-3-phenylpropanoyl]amino]pentanoate Traditional Name: disodium 4-methyl-2-[[2-[[methyl(oxido)thiophosphoryl]amino]-3-phenyl-propanoyl]amino]valerate Formula: C16H23N2Na2O4PS MolecularWeight: 416.383121

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)[O-])NC(=O)C(CC1=CC=CC=C1)NP(=S)(C)[O-].[Na+].[Na+]

Isomeric SMILES

CC(C)CC(C(=O)[O-])NC(=O)C(CC1=CC=CC=C1)NP(=S)(C)[O-].[Na+].[Na+]

InChI

InChI=1S/C16H25N2O4PS.2Na/c1-11(2)9-14(16(20)21)17-15(19)13(18-23(3,22)24)10-12-7-5-4-6-8-12;;/h4-8,11,13-14H,9-10H2,1-3H3,(H,17,19)(H,20,21)(H2,18,22,24);;/q;2*+1/p-2