Vitas-M small molecule compound

N-{2-[(2-methoxy-5-nitrobenzyl)sulfanyl]-1,3-benzothiazol-6-yl}naphthalene-1-carboxamide

Catalog ID
STK760882
SMILES COc1ccc(cc1CSc1nc2c(s1)cc(cc2)NC(=O)c1cccc2c1cccc2)[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 C26H19N3O4S2 MW 501.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19N3O4S2/c1-33-23-12-10-19(29(31)32)13-17(23)15-34-26-28-22-11-9-18(14-24(22)35-26)27-25(30)21-8-4-6-16-5-2-3-7-20(16)21/h2-14H,15H2,1H3,(H,27,30)
InChIKey
CRWADNZRDHGYED-UHFFFAOYSA-N
Synonyms

COC1=C(C=C(C=C1)(N+)(=O)(O))CSC2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC=CC5=CC=CC=C54
COc1ccc(cc1CSc1nc2c(s1)cc(cc2)NC(=O)c1cccc2c1cccc2)(N+)(=O)(O)
InChI=1SC26H19N3O4S2c13323121019(29(31)32)1317(23)153426282211918(1424(22)3526)2725(30)2184616523720(16)21h214H15H21H3(H2730)
MFCD01626375
N(2((2methoxy5nitrobenzyl)sulfanyl)13benzothiazol6yl)naphthalene1carboxamide
N(2((2METHOXY5NITROPHENYL)METHYLSULFANYL)13BENZOTHIAZOL6YL)NAPHTHALENE1CARBOXAMIDE
ZINC000003669544
ZINC03669544
ZINC3669544

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Available files

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