Vitas-M small molecule compound

N-[4-(4-chlorophenoxy)phenyl]-2-[(5-nitro-1H-benzimidazol-2-yl)sulfanyl]acetamide

Catalog ID
STK202481
SMILES O=C(Nc1ccc(cc1)Oc1ccc(cc1)Cl)CSc1nc2c([nH]1)ccc(c2)[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 C21H15ClN4O4S MW 454.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15ClN4O4S/c22-13-1-6-16(7-2-13)30-17-8-3-14(4-9-17)23-20(27)12-31-21-24-18-10-5-15(26(28)29)11-19(18)25-21/h1-11H,12H2,(H,23,27)(H,24,25)
InChIKey
BIKYLZKGRPITPY-UHFFFAOYSA-N
Synonyms
522593-55-1
522593551
C1=CC(=CC=C1NC(=O)CSC2=NC3=C(N2)C=C(C=C3)(N+)(=O)(O))OC4=CC=C(C=C4)Cl
InChI=1SC21H15ClN4O4Sc22131616(7213)30178314(4917)2320(27)123121241810515(26(28)29)1119(18)2521h111H12H2(H2327)(H2425)
MFCD03487015
N(4(4CHLOROPHENOXY)PHENYL)2((5NITRO1HBENZIMIDAZOL2YL)SULFANYL)ACETAMIDE
N(4(4chlorophenoxy)phenyl)2((5nitro1Hbenzo(d)imidazol2yl)thio)acetamide
N(4(4CHLOROPHENOXY)PHENYL)2((6NITRO1HBENZIMIDAZOL2YL)SULFANYL)ACETAMIDE
O=C(Nc1ccc(cc1)Oc1ccc(cc1)Cl)CSc1nc2c((nH)1)ccc(c2)(N+)(=O)(O)
ZINC000009328884
ZINC09328884
ZINC9328884

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Available files

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