prop-2-enyl (1Z,2S,3R)-N-(4-methylphenyl)sulfonyl-4-nitro-3-phenyl-2-pyridin-2-yl-butanimidate

Systemtic Name: prop-2-enyl (1Z,2S,3R)-N-(4-methylphenyl)sulfonyl-4-nitro-3-phenyl-2-pyridin-2-yl-butanimidate Openeye Name: allyl (1Z,2S,3R)-4-nitro-3-phenyl-N-(p-tolylsulfonyl)-2-(2-pyridyl)butanimidate CAS Name: (1Z,2S,3R)-N-(4-methylphenyl)sulfonyl-4-nitro-3-phenyl-2-(2-pyridinyl)butanimidic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (1Z,2S,3R)-N-(4-methylphenyl)sulfonyl-4-nitro-3-phenyl-2-pyridin-2-ylbutanimidate Traditional Name: (1Z,2S,3R)-4-nitro-3-phenyl-2-(2-pyridyl)-N-tosyl-butyrimidic acid allyl ester Formula: C25H25N3O5S MolecularWeight: 479.5481

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N=C(C(C2=CC=CC=N2)C(C[N+](=O)[O-])C3=CC=CC=C3)OCC=C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/N=C(/[C@H](C2=CC=CC=N2)[C@@H](C[N+](=O)[O-])C3=CC=CC=C3)\OCC=C

InChI

InChI=1S/C25H25N3O5S/c1-3-17-33-25(27-34(31,32)21-14-12-19(2)13-15-21)24(23-11-7-8-16-26-23)22(18-28(29)30)20-9-5-4-6-10-20/h3-16,22,24H,1,17-18H2,2H3/b27-25-/t22-,24-/m0/s1