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Substance Name: TAK-901 hydrochloride
RN: 934542-50-4
UNII: 3Y4400C9E8
InChIKey: VJCDELBBEITKBS-UHFFFAOYSA-N

Molecular Formula

  • C28-H32-N4-O3-S.Cl-H

Molecular Weight

  • 541.1127
 
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Names and Synonyms

Name of Substance

  • TAK-901 hydrochloride

Synonyms

  • 9H-Pyrido(2,3-b)indole-7-carboxamide, 5-(3-(ethylsulfonyl)phenyl)-3,8-dimethyl-N-(1-methyl-4-piperidinyl)-, monohydrochloride
  • TAK-901 hydrochloride
  • UNII-3Y4400C9E8

Registry Numbers

CAS Registry Number

  • 934542-50-4

FDA UNII

  • 3Y4400C9E8

System Generated Number

  • 0934542504

Structure Descriptors

InChI

1S/C28H32N4O3S.ClH/c1-5-36(34,35)21-8-6-7-19(14-21)23-15-22(28(33)30-20-9-11-32(4)12-10-20)18(3)26-25(23)24-13-17(2)16-29-27(24)31-26;/h6-8,13-16,20H,5,9-12H2,1-4H3,(H,29,31)(H,30,33);1H

InChIKey

VJCDELBBEITKBS-UHFFFAOYSA-N

Smiles

CCS(=O)(=O)c1cccc(c1)c2cc(c(c3c2c4cc(cnc4[nH]3)C)C)C(=O)NC5CCN(CC5)C.Cl