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Details

Stereochemistry ACHIRAL
Molecular Formula C21H28N6O3S2
Molecular Weight 476.615
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DESMETHYLTHIOSILDENAFIL

SMILES

CCCC1=NN(C)C2=C1NC(=NC2=S)C3=C(OCC)C=CC(=C3)S(=O)(=O)N4CCNCC4

InChI

InChIKey=VMDTWBKYCKLNLA-UHFFFAOYSA-N
InChI=1S/C21H28N6O3S2/c1-4-6-16-18-19(26(3)25-16)21(31)24-20(23-18)15-13-14(7-8-17(15)30-5-2)32(28,29)27-11-9-22-10-12-27/h7-8,13,22H,4-6,9-12H2,1-3H3,(H,23,24,31)

HIDE SMILES / InChI

Molecular Formula C21H28N6O3S2
Molecular Weight 476.615
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:50:16 GMT 2023
Edited
by admin
on Sat Dec 16 10:50:16 GMT 2023
Record UNII
VR6TSW7UDN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DESMETHYLTHIOSILDENAFIL
Common Name English
DESMETHYL THIOSILDENAFIL
Common Name English
N-DESMETHYLTHIOSILDENAFIL
Common Name English
7H-PYRAZOLO(4,3-D)PYRIMIDINE-7-THIONE, 5-(2-ETHOXY-5-(1-PIPERAZINYLSULFONYL)PHENYL)-1,6-DIHYDRO-1-METHYL-3-PROPYL-
Systematic Name English
PIPERAZINE, 1-((3-(4,7-DIHYDRO-1-METHYL-3-PROPYL-7-THIOXO-1H-PYRAZOLO(4,3-D)PYRIMIDIN-5-YL)-4-ETHOXYPHENYL)SULFONYL)-
Systematic Name English
Code System Code Type Description
PUBCHEM
10140449
Created by admin on Sat Dec 16 10:50:16 GMT 2023 , Edited by admin on Sat Dec 16 10:50:16 GMT 2023
PRIMARY
EPA CompTox
DTXSID30436111
Created by admin on Sat Dec 16 10:50:16 GMT 2023 , Edited by admin on Sat Dec 16 10:50:16 GMT 2023
PRIMARY
CAS
479073-86-4
Created by admin on Sat Dec 16 10:50:16 GMT 2023 , Edited by admin on Sat Dec 16 10:50:16 GMT 2023
PRIMARY
FDA UNII
VR6TSW7UDN
Created by admin on Sat Dec 16 10:50:16 GMT 2023 , Edited by admin on Sat Dec 16 10:50:16 GMT 2023
PRIMARY