Vitas-M small molecule compound

4-chloro-2-({[1-(prop-2-en-1-yl)-1H-benzimidazol-2-yl]amino}methyl)phenol

Catalog ID
STK002646
SMILES C=CCn1c(NCc2cc(Cl)ccc2O)nc2c1cccc2

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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 C17H16ClN3O MW 313.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16ClN3O/c1-2-9-21-15-6-4-3-5-14(15)20-17(21)19-11-12-10-13(18)7-8-16(12)22/h2-8,10,22H,1,9,11H2,(H,19,20)
InChIKey
KUXSWSATKWQRNU-UHFFFAOYSA-N
Synonyms
731832-02-3
2(((1allyl1Hbenzo(d)imidazol2yl)amino)methyl)4chlorophenol
2(((1ALLYLBENZIMIDAZOL2YL)AMINO)METHYL)4CHLOROPHENOL
2((1ALLYL1HBENZOIMIDAZOL2YLAMINO)METHYL)4CHLOROPHENOL
4CHLORANYL2(((1PROP2ENYLBENZIMIDAZOL2YL)AMINO)METHYL)PHENOL
4CHLORO2(((1(PROP2EN1YL)1HBENZIMIDAZOL2YL)AMINO)METHYL)PHENOL
4CHLORO2(((1PROP2ENYL2BENZIMIDAZOLYL)AMINO)METHYL)PHENOL
4CHLORO2(((1PROP2ENYLBENZIMIDAZOL2YL)AMINO)METHYL)PHENOL
731832023
C=CCn1c(NCc2cc(Cl)ccc2O)nc2c1cccc2
C=CCN1C2=CC=CC=C2N=C1NCC3=C(C=CC(=C3)Cl)O
InChI=1SC17H16ClN3Oc1292115643514(15)2017(21)1911121013(18)7816(12)22h281022H1911H2(H1920)
MFCD03677598
STK002646
ZINC000000554246
ZINC554246

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Available files

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