Vitas-M small molecule compound
1,2,2-trimethyl-3-{[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]carbamoyl}cyclopentanecarboxylic acid
Catalog ID
STK391300
SMILES O=C(C1CCC(C1(C)C)(C)C(=O)O)Nc1ccc(cc1)c1nc2c(s1)cc(cc2)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 C24H26N2O3S MW 422.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N2O3S/c1-14-5-10-18-19(13-14)30-21(26-18)15-6-8-16(9-7-15)25-20(27)17-11-12-24(4,22(28)29)23(17,2)3/h5-10,13,17H,11-12H2,1-4H3,(H,25,27)(H,28,29)InChIKey
KMRYYYNQJSCGDY-UHFFFAOYSA-NSynonyms
122TRIMETHYL3((4(6METHYL13BENZOTHIAZOL2YL)PHENYL)CARBAMOYL)CYCLOPENTANE1CARBOXYLICACID
122trimethyl3((4(6methyl13benzothiazol2yl)phenyl)carbamoyl)cyclopentanecarboxylicacid
122TRIMETHYL3(N(4(6METHYLBENZOTHIAZOL2YL)PHENYL)CARBAMOYL)CYCLOPENTANECARBOXYLICACID
CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C4CCC(C4(C)C)(C)C(=O)O
InChI=1SC24H26N2O3Sc1145101819(1314)3021(2618)156816(9715)2520(27)17111224(422(28)29)23(172)3h5101317H1112H214H3(H2527)(H2829)
MFCD00554982
ZINC000000705195
ZINC000000705198
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