ethyl 5-[4-methoxy-3-(4-phenylpiperazin-1-yl)sulfonyl-phenyl]-1,2-oxazole-3-carboxylate

Systemtic Name: ethyl 5-[4-methoxy-3-(4-phenylpiperazin-1-yl)sulfonyl-phenyl]-1,2-oxazole-3-carboxylate Openeye Name: ethyl 5-[4-methoxy-3-(4-phenylpiperazin-1-yl)sulfonyl-phenyl]isoxazole-3-carboxylate CAS Name: 5-[4-methoxy-3-[(4-phenyl-1-piperazinyl)sulfonyl]phenyl]-3-isoxazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[4-methoxy-3-(4-phenylpiperazin-1-yl)sulfonylphenyl]-1,2-oxazole-3-carboxylate Traditional Name: 5-[4-methoxy-3-(4-phenylpiperazino)sulfonyl-phenyl]isoxazole-3-carboxylic acid ethyl ester Formula: C23H25N3O6S MolecularWeight: 471.5261

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NOC(=C1)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=NOC(=C1)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C23H25N3O6S/c1-3-31-23(27)19-16-21(32-24-19)17-9-10-20(30-2)22(15-17)33(28,29)26-13-11-25(12-14-26)18-7-5-4-6-8-18/h4-10,15-16H,3,11-14H2,1-2H3