Vitas-M small molecule compound
N-[2-(1H-benzimidazol-2-yl)ethyl]-4-(4-nitro-1H-pyrazol-1-yl)butanamide
Catalog ID
STK685409
SMILES O=C(NCCc1nc2c([nH]1)cccc2)CCCn1ncc(c1)[N+](=O)[O-]
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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 C16H18N6O3 MW 342.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N6O3/c23-16(6-3-9-21-11-12(10-18-21)22(24)25)17-8-7-15-19-13-4-1-2-5-14(13)20-15/h1-2,4-5,10-11H,3,6-9H2,(H,17,23)(H,19,20)InChIKey
HJYFWXVQQHFCQM-UHFFFAOYSA-NSynonyms
C1=CC=C2C(=C1)NC(=N2)CCNC(=O)CCCN3C=C(C=N3)(N+)(=O)(O)
InChI=1SC16H18N6O3c2316(639211112(101821)22(24)25)1787151913412514(13)2015h12451011H369H2(H1723)(H1920)
MFCD05858781
N(2(1Hbenzimidazol2yl)ethyl)4(4nitro1Hpyrazol1yl)butanamide
N(2(1HBENZIMIDAZOL2YL)ETHYL)4(4NITROPYRAZOL1YL)BUTANAMIDE
N(2BENZIMIDAZOL2YLETHYL)4(4NITROPYRAZOLYL)BUTANAMIDE
O=C(NCCc1nc2c((nH)1)cccc2)CCCn1ncc(c1)(N+)(=O)(O)
ZINC000001429947
ZINC01429947
ZINC1429947
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