Vitas-M small molecule compound

N-(1,3-benzothiazol-2-yl)-5-(2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamide

Catalog ID
STL470057
SMILES O=C1NC2C(N1)C(SC2)CCCCC(=O)Nc1nc2c(s1)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 C17H20N4O2S2 MW 376.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N4O2S2/c22-14(20-17-19-10-5-1-2-6-12(10)25-17)8-4-3-7-13-15-11(9-24-13)18-16(23)21-15/h1-2,5-6,11,13,15H,3-4,7-9H2,(H2,18,21,23)(H,19,20,22)
InChIKey
AQZKODBLWDKBDP-UHFFFAOYSA-N
Synonyms
1219363-61-7
1219363617
C1C2C(C(S1)CCCCC(=O)NC3=NC4=CC=CC=C4S3)NC(=O)N2
InChI=1SC17H20N4O2S2c2214(20171910512612(10)2517)8437131511(92413)1816(23)2115h1256111315H3479H2(H2182123)(H192022)
MFCD11775935
N(13benzothiazol2yl)5(2oxo133a466ahexahydrothieno(34d)imidazol4yl)pentanamide
N(13benzothiazol2yl)5(2oxohexahydro1Hthieno(34d)imidazol4yl)pentanamide
N(benzo(d)thiazol2yl)5((3aS4S6aR)2oxohexahydro1Hthieno(34d)imidazol4yl)pentanamide
O=C1N(C@@H)2(C@H)(N1)(C@@H)(SC2)CCCCC(=O)Nc1nc2c(s1)cccc2
ZINC000032843330
ZINC000104695209

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Available files

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