Vitas-M small molecule compound

(2E)-2-(acetylimino)-N-(2-methylpropyl)-2,3-dihydro-1,3-benzothiazole-6-carboxamide

Catalog ID
STK645529
SMILES CC(CNC(=O)c1ccc2c(c1)s/c(=N/C(=O)C)/[nH]2)C

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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 C14H17N3O2S MW 291.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H17N3O2S/c1-8(2)7-15-13(19)10-4-5-11-12(6-10)20-14(17-11)16-9(3)18/h4-6,8H,7H2,1-3H3,(H,15,19)(H,16,17,18)
InChIKey
AGCJVEBNEBGTER-UHFFFAOYSA-N
Synonyms
951937-03-4
(2E)2(acetylimino)N(2methylpropyl)23dihydro13benzothiazole6carboxamide
2acetamidoN(2methylpropyl)13benzothiazole6carboxamide
951937034
CC(C)CNC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C
CC(CNC(=O)c1ccc2c(c1)sc(=NC(=O)C)(nH)2)C
InChI=1SC14H17N3O2Sc18(2)71513(19)10451112(610)2014(1711)169(3)18h468H7H213H3(H1519)(H161718)
MFCD18163950
ZINC000013726857
ZINC13726857

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Available files

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