Vitas-M small molecule compound
2-[(1-benzyl-1H-benzimidazol-2-yl)sulfanyl]-1-(4-nitrophenyl)ethanone
Catalog ID
STK205503
SMILES O=C(c1ccc(cc1)[N+](=O)[O-])CSc1nc2c(n1Cc1ccccc1)cccc2
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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 C22H17N3O3S MW 403.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N3O3S/c26-21(17-10-12-18(13-11-17)25(27)28)15-29-22-23-19-8-4-5-9-20(19)24(22)14-16-6-2-1-3-7-16/h1-13H,14-15H2InChIKey
FOCZTJDDUVYZRC-UHFFFAOYSA-NSynonyms
2((1BENZYL1HBENZIMIDAZOL2YL)SULFANYL)1(4NITROPHENYL)ETHANONE
2(1BENZYLBENZIMIDAZOL2YL)SULFANYL1(4NITROPHENYL)ETHANONE
C1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2SCC(=O)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC22H17N3O3Sc2621(17101218(131117)25(27)28)1529222319845920(19)24(22)14166213716h113H1415H2
MFCD04214461
O=C(c1ccc(cc1)(N+)(=O)(O))CSc1nc2c(n1Cc1ccccc1)cccc2
ZINC000001130759
ZINC01130759
ZINC1130759
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