6-tert-butyl-4-(2-fluorophenyl)sulfonyl-8-piperazin-1-yl-2,3-dihydro-1,4-benzoxazine

Systemtic Name: 6-tert-butyl-4-(2-fluorophenyl)sulfonyl-8-piperazin-1-yl-2,3-dihydro-1,4-benzoxazine Openeye Name: 6-tert-butyl-4-(2-fluorophenyl)sulfonyl-8-piperazin-1-yl-2,3-dihydro-1,4-benzoxazine CAS Name: 6-tert-butyl-4-(2-fluorophenyl)sulfonyl-8-(1-piperazinyl)-2,3-dihydro-1,4-benzoxazine IUPAC Name: 6-tert-butyl-4-(2-fluorophenyl)sulfonyl-8-piperazin-1-yl-2,3-dihydro-1,4-benzoxazine Traditional Name: 6-tert-butyl-4-(2-fluorophenyl)sulfonyl-8-piperazino-2,3-dihydro-1,4-benzoxazine Formula: C22H28FN3O3S MolecularWeight: 433.539423

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C2C(=C1)N(CCO2)S(=O)(=O)C3=CC=CC=C3F)N4CCNCC4

Isomeric SMILES

CC(C)(C)C1=CC(=C2C(=C1)N(CCO2)S(=O)(=O)C3=CC=CC=C3F)N4CCNCC4

InChI

InChI=1S/C22H28FN3O3S/c1-22(2,3)16-14-18(25-10-8-24-9-11-25)21-19(15-16)26(12-13-29-21)30(27,28)20-7-5-4-6-17(20)23/h4-7,14-15,24H,8-13H2,1-3H3