1-ethyl-3-[3-[4-(5-ethylsulfonyl-1,3-benzoxazol-2-yl)-1H-pyrazol-5-yl]phenyl]urea

Systemtic Name: 1-ethyl-3-[3-[4-(5-ethylsulfonyl-1,3-benzoxazol-2-yl)-1H-pyrazol-5-yl]phenyl]urea Openeye Name: 1-ethyl-3-[3-[4-(5-ethylsulfonyl-1,3-benzoxazol-2-yl)-1H-pyrazol-5-yl]phenyl]urea CAS Name: 1-ethyl-3-[3-[4-(5-ethylsulfonyl-1,3-benzoxazol-2-yl)-1H-pyrazol-5-yl]phenyl]urea IUPAC Name: 1-ethyl-3-[3-[4-(5-ethylsulfonyl-1,3-benzoxazol-2-yl)-1H-pyrazol-5-yl]phenyl]urea Traditional Name: 1-[3-[4-(5-esyl-1,3-benzoxazol-2-yl)-1H-pyrazol-5-yl]phenyl]-3-ethyl-urea Formula: C21H21N5O4S MolecularWeight: 439.48754

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC1=CC=CC(=C1)C2=C(C=NN2)C3=NC4=C(O3)C=CC(=C4)S(=O)(=O)CC

Isomeric SMILES

CCNC(=O)NC1=CC=CC(=C1)C2=C(C=NN2)C3=NC4=C(O3)C=CC(=C4)S(=O)(=O)CC

InChI

InChI=1S/C21H21N5O4S/c1-3-22-21(27)24-14-7-5-6-13(10-14)19-16(12-23-26-19)20-25-17-11-15(31(28,29)4-2)8-9-18(17)30-20/h5-12H,3-4H2,1-2H3,(H,23,26)(H2,22,24,27)