(6-chloranyl-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl)-[1-[[5-[(E)-2-(2-fluorophenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl]sulfonyl]piperidin-4-yl]methanone

Systemtic Name: (6-chloranyl-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl)-[1-[[5-[(E)-2-(2-fluorophenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl]sulfonyl]piperidin-4-yl]methanone Openeye Name: (6-chloro-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl)-[1-[5-[(E)-2-(2-fluorophenyl)vinyl]-3-methyl-isoxazol-4-yl]sulfonyl-4-piperidyl]methanone CAS Name: (6-chloro-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl)-[1-[[5-[(E)-2-(2-fluorophenyl)ethenyl]-3-methyl-4-isoxazolyl]sulfonyl]-4-piperidinyl]methanone IUPAC Name: (6-chloro-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl)-[1-[[5-[(E)-2-(2-fluorophenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl]sulfonyl]piperidin-4-yl]methanone Traditional Name: (6-chloro-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl)-[1-[5-[(E)-2-(2-fluorophenyl)vinyl]-3-methyl-isoxazol-4-yl]sulfonyl-4-piperidyl]methanone Formula: C28H29ClFN3O5S MolecularWeight: 574.063363

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(C2=C(O1)C=CC(=C2)Cl)C(=O)C3CCN(CC3)S(=O)(=O)C4=C(ON=C4C)C=CC5=CC=CC=C5F

Isomeric SMILES

CCC1CN(C2=C(O1)C=CC(=C2)Cl)C(=O)C3CCN(CC3)S(=O)(=O)C4=C(ON=C4C)/C=C/C5=CC=CC=C5F

InChI

InChI=1S/C28H29ClFN3O5S/c1-3-22-17-33(24-16-21(29)9-11-25(24)37-22)28(34)20-12-14-32(15-13-20)39(35,36)27-18(2)31-38-26(27)10-8-19-6-4-5-7-23(19)30/h4-11,16,20,22H,3,12-15,17H2,1-2H3/b10-8+