Vitas-M small molecule compound

1-butyl-N-[(2E)-3-(4-chlorophenyl)prop-2-en-1-yl]-1H-tetrazol-5-amine

Catalog ID
STK280474
SMILES CCCCn1nnnc1NC/C=C/c1ccc(cc1)Cl

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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 C14H18ClN5 MW 291.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H18ClN5/c1-2-3-11-20-14(17-18-19-20)16-10-4-5-12-6-8-13(15)9-7-12/h4-9H,2-3,10-11H2,1H3,(H,16,17,19)/b5-4+
InChIKey
VAXXZRSCPDTDLF-SNAWJCMRSA-N
Synonyms

1BUTYLN((2E)3(4CHLOROPHENYL)PROP2EN1YL)1HTETRAZOL5AMINE
1BUTYLN((E)3(4CHLOROPHENYL)PROP2ENYL)TETRAZOL5AMINE
CCCCN1C(=NN=N1)NCC=CC2=CC=C(C=C2)Cl
CCCCn1nnnc1NCC=Cc1ccc(cc1)Cl
InChI=1SC14H18ClN5c123112014(17181920)161045126813(15)9712h49H231011H21H3(H161719)b54+
MFCD07173719
ZINC000007262101
ZINC07262101
ZINC7262101

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Available files

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