5-ethylsulfonyl-2-[(E)-2-(1-phenylpyrazol-4-yl)ethenyl]-1,3-benzoxazole

Systemtic Name: 5-ethylsulfonyl-2-[(E)-2-(1-phenylpyrazol-4-yl)ethenyl]-1,3-benzoxazole Openeye Name: 5-ethylsulfonyl-2-[(E)-2-(1-phenylpyrazol-4-yl)vinyl]-1,3-benzoxazole CAS Name: 5-ethylsulfonyl-2-[(E)-2-(1-phenyl-4-pyrazolyl)ethenyl]-1,3-benzoxazole IUPAC Name: 5-ethylsulfonyl-2-[(E)-2-(1-phenylpyrazol-4-yl)ethenyl]-1,3-benzoxazole Traditional Name: 5-esyl-2-[(E)-2-(1-phenylpyrazol-4-yl)vinyl]-1,3-benzoxazole Formula: C20H17N3O3S MolecularWeight: 379.43228

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC2=C(C=C1)OC(=N2)C=CC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

CCS(=O)(=O)C1=CC2=C(C=C1)OC(=N2)/C=C/C3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C20H17N3O3S/c1-2-27(24,25)17-9-10-19-18(12-17)22-20(26-19)11-8-15-13-21-23(14-15)16-6-4-3-5-7-16/h3-14H,2H2,1H3/b11-8+