Vitas-M small molecule compound
5-(4-methoxy-3-nitrophenyl)-3-phenyl-2-thioxo-2,3,5,6-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-7(4H)-one
Catalog ID
STL364664
SMILES COc1ccc(cc1[N+](=O)[O-])C1NC(=O)c2c(N1)n(c1ccccc1)c(=S)s2
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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 C18H14N4O4S2 MW 414.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14N4O4S2/c1-26-13-8-7-10(9-12(13)22(24)25)15-19-16-14(17(23)20-15)28-18(27)21(16)11-5-3-2-4-6-11/h2-9,15,19H,1H3,(H,20,23)InChIKey
KAVQYYATRPEQHY-UHFFFAOYSA-NSynonyms
5(4METHOXY3NITROPHENYL)3PHENYL2SULFANYLIDENE56DIHYDRO4H(13)THIAZOLO(45D)PYRIMIDIN7ONE
5(4methoxy3nitrophenyl)3phenyl2thioxo2356tetrahydro(13)thiazolo(45d)pyrimidin7(4H)one
5(4METHOXY3NITROPHENYL)3PHENYL2THIOXO456TRIHYDRO13THIAZOLINO(45D)PYRIMIDIN7ONE
COC1=C(C=C(C=C1)C2NC3=C(C(=O)N2)SC(=S)N3C4=CC=CC=C4)(N+)(=O)(O)
COc1ccc(cc1(N+)(=O)(O))C1NC(=O)c2c(N1)n(c1ccccc1)c(=S)s2
InChI=1SC18H14N4O4S2c126138710(912(13)22(24)25)15191614(17(23)2015)2818(27)21(16)115324611h291519H1H3(H2023)
MFCD03546502
ZINC000009236355
ZINC000009236357
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