Vitas-M small molecule compound
(2E)-N-(bicyclo[2.2.1]hept-5-en-2-ylmethyl)-2-[(methylsulfonyl)imino]-2,3-dihydro-1,3-benzothiazole-6-carboxamide
Catalog ID
STK658841
SMILES O=C(c1ccc2c(c1)s/c(=N/S(=O)(=O)C)/[nH]2)NCC1CC2CC1C=C2
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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 C17H19N3O3S2 MW 377.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N3O3S2/c1-25(22,23)20-17-19-14-5-4-12(8-15(14)24-17)16(21)18-9-13-7-10-2-3-11(13)6-10/h2-5,8,10-11,13H,6-7,9H2,1H3,(H,18,21)(H,19,20)InChIKey
SHJCPSSUUXMZIY-UHFFFAOYSA-NSynonyms
1212271-44-7(2E)N(bicyclo(221)hept5en2ylmethyl)2((methylsulfonyl)imino)23dihydro13benzothiazole6carboxamide
1212271447
CS(=O)(=O)NC1=NC2=C(S1)C=C(C=C2)C(=O)NCC3CC4CC3C=C4
InChI=1SC17H19N3O3S2c125(2223)201719145412(815(14)2417)16(21)189137102311(13)610h258101113H679H21H3(H1821)(H1920)
MFCD18168511
N(5bicyclo(221)hept2enylmethyl)2(methanesulfonamido)13benzothiazole6carboxamide
O=C(c1ccc2c(c1)sc(=NS(=O)(=O)C)(nH)2)NCC1CC2CC1C=C2
ZINC000101616153
ZINC000101616156
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