Vitas-M small molecule compound
N-{(2S)-1-[(1,1-dioxidotetrahydrothiophen-3-yl)amino]-1-oxopropan-2-yl}-2-(1H-pyrrol-1-yl)-1,3-benzothiazole-6-carboxamide
Catalog ID
STK658030
SMILES O=C([C@@H](NC(=O)c1ccc2c(c1)sc(n2)n1cccc1)C)NC1CCS(=O)(=O)C1
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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 C19H20N4O4S2 MW 432.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N4O4S2/c1-12(17(24)21-14-6-9-29(26,27)11-14)20-18(25)13-4-5-15-16(10-13)28-19(22-15)23-7-2-3-8-23/h2-5,7-8,10,12,14H,6,9,11H2,1H3,(H,20,25)(H,21,24)/t12-,14?/m0/s1InChIKey
LGYCCHKDXTXMJL-NBFOIZRFSA-NSynonyms
1214624-15-31214624153
CC(C(=O)NC1CCS(=O)(=O)C1)NC(=O)C2=CC3=C(C=C2)N=C(S3)N4C=CC=C4
InChI=1SC19H20N4O4S2c112(17(24)21146929(2627)1114)2018(25)13451516(1013)2819(2215)23723823h2578101214H6911H21H3(H2025)(H2124)t1214?m0s1
MFCD18168228
N((2S)1((11dioxidotetrahydrothiophen3yl)amino)1oxopropan2yl)2(1Hpyrrol1yl)13benzothiazole6carboxamide
N((2S)1((11dioxidotetrahydrothiophen3yl)amino)1oxopropan2yl)2(1Hpyrrol1yl)benzo(d)thiazole6carboxamide
N((2S)1((11dioxothiolan3yl)amino)1oxopropan2yl)2pyrrol1yl13benzothiazole6carboxamide
O=C((C@@H)(NC(=O)c1ccc2c(c1)sc(n2)n1cccc1)C)NC1CCS(=O)(=O)C1
ZINC000032091729
ZINC000032091732
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