Vitas-M small molecule compound
2-[3-(4-chlorophenyl)-1H-pyrazol-4-yl]-2,3,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4(1H)-one
Catalog ID
STK690144
SMILES Clc1ccc(cc1)c1n[nH]cc1C1NC(=O)c2c(N1)sc1c2CCCC1
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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 C19H17ClN4OS MW 384.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17ClN4OS/c20-11-7-5-10(6-8-11)16-13(9-21-24-16)17-22-18(25)15-12-3-1-2-4-14(12)26-19(15)23-17/h5-9,17,23H,1-4H2,(H,21,24)(H,22,25)InChIKey
PWPUXSGFVYNZGM-UHFFFAOYSA-NSynonyms
2(3(4chlorophenyl)1Hpyrazol4yl)235678hexahydro(1)benzothieno(23d)pyrimidin4(1H)one
2(5(4chlorophenyl)1Hpyrazol4yl)235678hexahydro1H(1)benzothiolo(23d)pyrimidin4one
C1CCC2=C(C1)C3=C(S2)NC(NC3=O)C4=C(NN=C4)C5=CC=C(C=C5)Cl
Clc1ccc(cc1)c1n(nH)cc1C1NC(=O)c2c(N1)sc1c2CCCC1
InChI=1SC19H17ClN4OSc20117510(6811)1613(9212416)172218(25)1512312414(12)2619(15)2317h591723H14H2(H2124)(H2225)
MFCD09063240
ZINC000012374680
ZINC000012374681
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