8-fluoranyl-12-(4-propan-2-ylpiperazin-1-yl)-6H-[1]benzothiolo[2,3-b][1,5]benzodiazepine

Systemtic Name: 8-fluoranyl-12-(4-propan-2-ylpiperazin-1-yl)-6H-[1]benzothiolo[2,3-b][1,5]benzodiazepine Openeye Name: 8-fluoro-12-(4-isopropylpiperazin-1-yl)-6H-benzothiopheno[2,3-b][1,5]benzodiazepine CAS Name: 8-fluoro-12-(4-propan-2-yl-1-piperazinyl)-6H-[1]benzothiolo[2,3-b][1,5]benzodiazepine IUPAC Name: 8-fluoro-12-(4-propan-2-ylpiperazin-1-yl)-6H-[1]benzothiolo[2,3-b][1,5]benzodiazepine Traditional Name: 8-fluoro-12-(4-isopropylpiperazino)-6H-benzothiopheno[2,3-b][1,5]benzodiazepine Formula: C22H23FN4S MolecularWeight: 394.508223

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(CC1)C2=NC3=C(C=C(C=C3)F)NC4=C2C5=CC=CC=C5S4

Isomeric SMILES

CC(C)N1CCN(CC1)C2=NC3=C(C=C(C=C3)F)NC4=C2C5=CC=CC=C5S4

InChI

InChI=1S/C22H23FN4S/c1-14(2)26-9-11-27(12-10-26)21-20-16-5-3-4-6-19(16)28-22(20)25-18-13-15(23)7-8-17(18)24-21/h3-8,13-14,25H,9-12H2,1-2H3