Vitas-M small molecule compound
prop-2-en-1-yl 6-[(6-ethoxy-1,3-benzothiazol-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylate
Catalog ID
STK499585
SMILES C=CCOC(=O)C1CC=CCC1C(=O)Nc1nc2c(s1)cc(cc2)OCC
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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 C20H22N2O4S MW 386.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O4S/c1-3-11-26-19(24)15-8-6-5-7-14(15)18(23)22-20-21-16-10-9-13(25-4-2)12-17(16)27-20/h3,5-6,9-10,12,14-15H,1,4,7-8,11H2,2H3,(H,21,22,23)InChIKey
MJBMFCNREZVNOJ-UHFFFAOYSA-NSynonyms
CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CC=CCC3C(=O)OCC=C
InChI=1SC20H22N2O4Sc13112619(24)15865714(15)18(23)2220211610913(2542)1217(16)2720h356910121415H147811H22H3(H212223)
MFCD01244064
PROP2EN1YL(1R6R)6((6ETHOXY13BENZOTHIAZOL2YL)CARBAMOYL)CYCLOHEX3ENE1CARBOXYLATE
PROP2EN1YL(1R6S)6((6ETHOXY13BENZOTHIAZOL2YL)CARBAMOYL)CYCLOHEX3ENE1CARBOXYLATE
prop2en1yl6((6ethoxy13benzothiazol2yl)carbamoyl)cyclohex3ene1carboxylate
PROP2ENYL6((6ETHOXY13BENZOTHIAZOL2YL)CARBAMOYL)CYCLOHEX3ENE1CARBOXYLATE
ZINC000002893024
ZINC000002893027
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