HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program：[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

CIMETIDINE,3-NITRO-4,5-DIHYDROPYRROL-YL ANALOG

HCID 12831749
NotesReactions

Completing data — refresh the page later to see the latest

Basic informationNames & identifiersRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
74188-64-0
Standard SMILES
Cc1[nH]cnc1CSCCNC1=C([N+](=O)[O-])CCN1
InChIKey
OHOFEMJCYPWXRL-UHFFFAOYSA-N
Molecular formula
C11H17N5O2S
Average molar mass
283.357 g/mol
Monoisotopic mass
283.11029578

Names & identifiers

Preferred name
CIMETIDINE,3-NITRO-4,5-DIHYDROPYRROL-YL ANALOG
IUPAC
N-(2-{[(4-Methyl-1H-imidazol-5-yl)methyl]sulfanyl}ethyl)-3-nitro-4,5-dihydro-1H-pyrrol-2-amine

Database identifiers

CAS
74188-64-0
PubChem CID
12831749
DTXSID
DTXSID70876577
ChEMBL
CHEMBL144809

Related reactions

6 records
New reaction record
HRID 160096 reaction equation
HRID 160096As productTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 542189 reaction equation
HRID 542189As productuspto-grants-1987_04
HRID 1248633 reaction equation
HRID 1248633As productuspto-grants-1985_06
HRID 1732602 reaction equation
HRID 1732602As productuspto-grants-1980_12
HRID 1995589 reaction equation
HRID 1995589As productuspto-grants-1983_09
HRID 2285708 reaction equation
HRID 2285708As productuspto-grants-1982_04

Compound notes

Loading…

On this pageBasic informationNames & identifiersRelated reactionsCompound notes