Vitas-M small molecule compound

N-(bicyclo[2.2.1]hept-5-en-2-ylmethyl)-4-phenyl-1,2,3-thiadiazole-5-carboxamide

Catalog ID
STK939639
SMILES O=C(c1snnc1c1ccccc1)NCC1CC2CC1C=C2

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C17H17N3OS MW 311.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3OS/c21-17(18-10-14-9-11-6-7-13(14)8-11)16-15(19-20-22-16)12-4-2-1-3-5-12/h1-7,11,13-14H,8-10H2,(H,18,21)
InChIKey
HTNFDZYPJCNEPI-UHFFFAOYSA-N
Synonyms
1212069-06-1
1212069061
C1C2CC(C1C=C2)CNC(=O)C3=C(N=NS3)C4=CC=CC=C4
InChI=1SC17H17N3OSc2117(1810149116713(14)811)1615(19202216)124213512h17111314H810H2(H1821)
MFCD13760951
N((2R)bicyclo(221)hept5en2ylmethyl)4phenyl123thiadiazole5carboxamide
N(5bicyclo(221)hept2enylmethyl)4phenylthiadiazole5carboxamide
N(bicyclo(221)hept5en2ylmethyl)4phenyl123thiadiazole5carboxamide
ZINC000101653972
ZINC000101653976

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.