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Concept information

Preferred term

1-butyl-3-(5-methyl-6-oxo-3-benzo[b][1,4]benzothiazepinyl)urea  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C19H21N3O2S

inchi

  • InChI=1S/C19H21N3O2S/c1-3-4-11-20-19(24)21-13-9-10-17-15(12-13)22(2)18(23)14-7-5-6-8-16(14)25-17/h5-10,12H,3-4,11H2,1-2H3,(H2,20,21,24)

inchikey

  • UGYXUEPBYOKNOL-UHFFFAOYSA-N

mass

  • 355.456

monoisotopicmass

  • 355.13545

smiles

  • CCCCNC(=O)NC1=CC2=C(C=C1)SC3=CC=CC=C3C(=O)N2C

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:121643

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