Vitas-M small molecule compound
2-[(4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide
Catalog ID
STL122253
SMILES O=C(Nc1cccc(c1)C(F)(F)F)CSc1nc2sc3c(c2c(=O)[nH]1)CCCC3
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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 C19H16F3N3O2S2 MW 439.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16F3N3O2S2/c20-19(21,22)10-4-3-5-11(8-10)23-14(26)9-28-18-24-16(27)15-12-6-1-2-7-13(12)29-17(15)25-18/h3-5,8H,1-2,6-7,9H2,(H,23,26)(H,24,25,27)InChIKey
WHANXXZJIRACNK-UHFFFAOYSA-NSynonyms
2((4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)N(3(trifluoromethyl)phenyl)acetamide
2((4oxo5678tetrahydro3H(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)N(3(trifluoromethyl)phenyl)acetamide
C1CCC2=C(C1)C3=C(S2)N=C(NC3=O)SCC(=O)NC4=CC=CC(=C4)C(F)(F)F
InChI=1SC19H16F3N3O2S2c2019(2122)1043511(810)2314(26)928182416(27)1512612713(12)2917(15)2518h358H12679H2(H2326)(H242527)
MFCD05342094
O=C(Nc1cccc(c1)C(F)(F)F)CSc1nc2sc3c(c2c(=O)(nH)1)CCCC3
ZINC000008640480
ZINC8640480
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