sodium (4-methylphenyl)sulfonyl-[3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]azanide

Systemtic Name: sodium (4-methylphenyl)sulfonyl-[3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]azanide Openeye Name: sodium [2-(benzyloxycarbonylamino)-3-phenyl-propanoyl]-(p-tolylsulfonyl)azanide CAS Name: sodium (4-methylphenyl)sulfonyl-[1-oxo-3-phenyl-2-(phenylmethoxycarbonylamino)propyl]azanide IUPAC Name: sodium (4-methylphenyl)sulfonyl-[3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]azanide Traditional Name: sodium [2-(benzyloxycarbonylamino)-3-phenyl-propanoyl]-tosyl-azanide Formula: C24H23N2NaO5S MolecularWeight: 474.50459

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[N-]C(=O)C(CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3.[Na+]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[N-]C(=O)C(CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3.[Na+]

InChI

InChI=1S/C24H24N2O5S.Na/c1-18-12-14-21(15-13-18)32(29,30)26-23(27)22(16-19-8-4-2-5-9-19)25-24(28)31-17-20-10-6-3-7-11-20;/h2-15,22H,16-17H2,1H3,(H2,25,26,27,28);/q;+1/p-1