(2R,3R)-5-azanyl-2-(4-bromophenyl)carbonyl-1-(4-methoxyphenyl)sulfonyl-3-phenyl-2,3-dihydropyrrole-4-carbonitrile

Systemtic Name: (2R,3R)-5-azanyl-2-(4-bromophenyl)carbonyl-1-(4-methoxyphenyl)sulfonyl-3-phenyl-2,3-dihydropyrrole-4-carbonitrile Openeye Name: (2R,3R)-5-amino-2-(4-bromobenzoyl)-1-(4-methoxyphenyl)sulfonyl-3-phenyl-2,3-dihydropyrrole-4-carbonitrile CAS Name: (2R,3R)-5-amino-2-[(4-bromophenyl)-oxomethyl]-1-(4-methoxyphenyl)sulfonyl-3-phenyl-2,3-dihydropyrrole-4-carbonitrile IUPAC Name: (2R,3R)-5-amino-2-(4-bromobenzoyl)-1-(4-methoxyphenyl)sulfonyl-3-phenyl-2,3-dihydropyrrole-4-carbonitrile Traditional Name: (4R,5R)-2-amino-5-(4-bromobenzoyl)-1-(4-methoxyphenyl)sulfonyl-4-phenyl-2-pyrroline-3-carbonitrile Formula: C25H20BrN3O4S MolecularWeight: 538.413

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2C(C(C(=C2N)C#N)C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2[C@H]([C@@H](C(=C2N)C#N)C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C25H20BrN3O4S/c1-33-19-11-13-20(14-12-19)34(31,32)29-23(24(30)17-7-9-18(26)10-8-17)22(21(15-27)25(29)28)16-5-3-2-4-6-16/h2-14,22-23H,28H2,1H3/t22-,23-/m1/s1