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Details

Stereochemistry ACHIRAL
Molecular Formula C16H11N5O
Molecular Weight 289.2914
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 3-benzylidenamino-5H-1,2,3-triazin(5,4b)indol-4-one

SMILES

O=C1N(\N=C\C2=CC=CC=C2)N=NC3=C1NC4=CC=CC=C34

InChI

InChIKey=WZTNSOFSNRSBFQ-LICLKQGHSA-N
InChI=1S/C16H11N5O/c22-16-15-14(12-8-4-5-9-13(12)18-15)19-20-21(16)17-10-11-6-2-1-3-7-11/h1-10,18H/b17-10+

HIDE SMILES / InChI

Molecular Formula C16H11N5O
Molecular Weight 289.2914
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:40:53 GMT 2023
Edited
by admin
on Sat Dec 16 09:40:53 GMT 2023
Record UNII
85GRY72Y2R
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-benzylidenamino-5H-1,2,3-triazin(5,4b)indol-4-one
Systematic Name English
3,5-DIHYDRO-3-((PHENYLMETHYLENE)AMINO)-4H-1,2,3-TRIAZINO(5,4-B)INDOL-4-ONE
Systematic Name English
4H-1,2,3-Triazino[5,4-b]indol-4-one, 3,5-dihydro-3-[(phenylmethylene)amino]-
Systematic Name English
Code System Code Type Description
FDA UNII
85GRY72Y2R
Created by admin on Sat Dec 16 09:40:53 GMT 2023 , Edited by admin on Sat Dec 16 09:40:53 GMT 2023
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CAS
135086-92-9
Created by admin on Sat Dec 16 09:40:53 GMT 2023 , Edited by admin on Sat Dec 16 09:40:53 GMT 2023
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EPA CompTox
DTXSID401030476
Created by admin on Sat Dec 16 09:40:53 GMT 2023 , Edited by admin on Sat Dec 16 09:40:53 GMT 2023
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PUBCHEM
9576819
Created by admin on Sat Dec 16 09:40:53 GMT 2023 , Edited by admin on Sat Dec 16 09:40:53 GMT 2023
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