6-fluoranyl-2,2-dimethyl-4-(phenylsulfonyl)-8-piperazin-1-yl-3H-1,4-benzoxazine

Systemtic Name: 6-fluoranyl-2,2-dimethyl-4-(phenylsulfonyl)-8-piperazin-1-yl-3H-1,4-benzoxazine Openeye Name: 4-(benzenesulfonyl)-6-fluoro-2,2-dimethyl-8-piperazin-1-yl-3H-1,4-benzoxazine CAS Name: 4-(benzenesulfonyl)-6-fluoro-2,2-dimethyl-8-(1-piperazinyl)-3H-1,4-benzoxazine IUPAC Name: 4-(benzenesulfonyl)-6-fluoro-2,2-dimethyl-8-piperazin-1-yl-3H-1,4-benzoxazine Traditional Name: 4-besyl-6-fluoro-2,2-dimethyl-8-piperazino-3H-1,4-benzoxazine Formula: C20H24FN3O3S MolecularWeight: 405.486263

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(C2=C(O1)C(=CC(=C2)F)N3CCNCC3)S(=O)(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1(CN(C2=C(O1)C(=CC(=C2)F)N3CCNCC3)S(=O)(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C20H24FN3O3S/c1-20(2)14-24(28(25,26)16-6-4-3-5-7-16)18-13-15(21)12-17(19(18)27-20)23-10-8-22-9-11-23/h3-7,12-13,22H,8-11,14H2,1-2H3