(2S)-2-[[(1R)-1-bis(phenylmethoxy)phosphorylpropyl]amino]-N-[(2S)-5-(dimethylamino)-1-(methylamino)-1-oxidanylidene-pentan-2-yl]-4-methyl-pentanamide

Systemtic Name: (2S)-2-[[(1R)-1-bis(phenylmethoxy)phosphorylpropyl]amino]-N-[(2S)-5-(dimethylamino)-1-(methylamino)-1-oxidanylidene-pentan-2-yl]-4-methyl-pentanamide Openeye Name: (2S)-2-[[(1R)-1-dibenzyloxyphosphorylpropyl]amino]-N-[(1S)-4-(dimethylamino)-1-(methylcarbamoyl)butyl]-4-methyl-pentanamide CAS Name: (2S)-2-[[(1R)-1-bis(phenylmethoxy)phosphorylpropyl]amino]-N-[(2S)-5-(dimethylamino)-1-(methylamino)-1-oxopentan-2-yl]-4-methylpentanamide IUPAC Name: (2S)-2-[[(1R)-1-bis(phenylmethoxy)phosphorylpropyl]amino]-N-[(2S)-5-(dimethylamino)-1-(methylamino)-1-oxopentan-2-yl]-4-methylpentanamide Traditional Name: (2S)-2-[[(1R)-1-dibenzoxyphosphorylpropyl]amino]-N-[(1S)-4-(dimethylamino)-1-(methylcarbamoyl)butyl]-4-methyl-valeramide Formula: C31H49N4O5P MolecularWeight: 588.718321

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Descriptors Computed from Structure

Canonical SMILES:

CCC(NC(CC(C)C)C(=O)NC(CCCN(C)C)C(=O)NC)P(=O)(OCC1=CC=CC=C1)OCC2=CC=CC=C2

Isomeric SMILES

CC[C@H](N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN(C)C)C(=O)NC)P(=O)(OCC1=CC=CC=C1)OCC2=CC=CC=C2

InChI

InChI=1S/C31H49N4O5P/c1-7-29(33-28(21-24(2)3)31(37)34-27(30(36)32-4)19-14-20-35(5)6)41(38,39-22-25-15-10-8-11-16-25)40-23-26-17-12-9-13-18-26/h8-13,15-18,24,27-29,33H,7,14,19-23H2,1-6H3,(H,32,36)(H,34,37)/t27-,28-,29+/m0/s1