methyl 3-[(3,5-diphenyl-1,2-oxazol-4-yl)sulfonyl]-4-phenyl-pyrrole-3-carboxylate

Systemtic Name: methyl 3-[(3,5-diphenyl-1,2-oxazol-4-yl)sulfonyl]-4-phenyl-pyrrole-3-carboxylate Openeye Name: methyl 3-(3,5-diphenylisoxazol-4-yl)sulfonyl-4-phenyl-pyrrole-3-carboxylate CAS Name: 3-[(3,5-diphenyl-4-isoxazolyl)sulfonyl]-4-phenyl-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 3-[(3,5-diphenyl-1,2-oxazol-4-yl)sulfonyl]-4-phenylpyrrole-3-carboxylate Traditional Name: 3-(3,5-diphenylisoxazol-4-yl)sulfonyl-4-phenyl-pyrrole-3-carboxylic acid methyl ester Formula: C27H20N2O5S MolecularWeight: 484.5231

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(C=NC=C1C2=CC=CC=C2)S(=O)(=O)C3=C(ON=C3C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

COC(=O)C1(C=NC=C1C2=CC=CC=C2)S(=O)(=O)C3=C(ON=C3C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H20N2O5S/c1-33-26(30)27(18-28-17-22(27)19-11-5-2-6-12-19)35(31,32)25-23(20-13-7-3-8-14-20)29-34-24(25)21-15-9-4-10-16-21/h2-18H,1H3