Vitas-M small molecule compound

N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[(5-nitro-1H-benzimidazol-2-yl)sulfanyl]acetamide

Catalog ID
STK220093
SMILES CCOc1ccc2c(c1)sc(n2)NC(=O)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 C18H15N5O4S2 MW 429.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15N5O4S2/c1-2-27-11-4-6-13-15(8-11)29-18(20-13)22-16(24)9-28-17-19-12-5-3-10(23(25)26)7-14(12)21-17/h3-8H,2,9H2,1H3,(H,19,21)(H,20,22,24)
InChIKey
GJRCWSQNHNJSEI-UHFFFAOYSA-N
Synonyms
540513-67-5
540513675
CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=NC4=C(N3)C=C(C=C4)(N+)(=O)(O)
CCOc1ccc2c(c1)sc(n2)NC(=O)CSc1nc2c((nH)1)ccc(c2)(N+)(=O)(O)
InChI=1SC18H15N5O4S2c122711461315(811)2918(2013)2216(24)9281719125310(23(25)26)714(12)2117h38H29H21H3(H1921)(H202224)
MFCD03196557
N(6ETHOXY13BENZOTHIAZOL2YL)2((5NITRO1HBENZIMIDAZOL2YL)SULFANYL)ACETAMIDE
N(6ETHOXY13BENZOTHIAZOL2YL)2((6NITRO1HBENZIMIDAZOL2YL)SULFANYL)ACETAMIDE
ZINC000002808139
ZINC02808139
ZINC2808139
ZINC33467166

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Available files

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