tert-butyl (NE)-N-[azanyl-[6-fluoranyl-4-(2-oxidanyl-1-phenyl-ethoxy)-1-benzothiophen-2-yl]methylidene]carbamate

Systemtic Name: tert-butyl (NE)-N-[azanyl-[6-fluoranyl-4-(2-oxidanyl-1-phenyl-ethoxy)-1-benzothiophen-2-yl]methylidene]carbamate Openeye Name: tert-butyl (NE)-N-[amino-[6-fluoro-4-(2-hydroxy-1-phenyl-ethoxy)benzothiophen-2-yl]methylene]carbamate CAS Name: (NE)-N-[amino-[6-fluoro-4-(2-hydroxy-1-phenylethoxy)-1-benzothiophen-2-yl]methylidene]carbamic acid tert-butyl ester IUPAC Name: tert-butyl (NE)-N-[amino-[6-fluoro-4-(2-hydroxy-1-phenylethoxy)-1-benzothiophen-2-yl]methylidene]carbamate Traditional Name: (NE)-N-[amino-[6-fluoro-4-(2-hydroxy-1-phenyl-ethoxy)benzothiophen-2-yl]methylene]carbamic acid tert-butyl ester Formula: C22H23FN2O4S MolecularWeight: 430.492423

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N=C(C1=CC2=C(S1)C=C(C=C2OC(CO)C3=CC=CC=C3)F)N

Isomeric SMILES

CC(C)(C)OC(=O)/N=C(\C1=CC2=C(S1)C=C(C=C2OC(CO)C3=CC=CC=C3)F)/N

InChI

InChI=1S/C22H23FN2O4S/c1-22(2,3)29-21(27)25-20(24)19-11-15-16(9-14(23)10-18(15)30-19)28-17(12-26)13-7-5-4-6-8-13/h4-11,17,26H,12H2,1-3H3,(H2,24,25,27)