Vitas-M small molecule compound
(2Z)-2-{[5-(4-nitrophenyl)furan-2-yl]methylidene}-6,7,8,9-tetrahydro-5H-[1]benzothieno[3,2-e][1,3]thiazolo[3,2-a]pyrimidine-1,5(2H)-dione
Catalog ID
STK766944
SMILES [O-][N+](=O)c1ccc(cc1)c1ccc(o1)/C=c/1\sc2n(c1=O)c1sc3c(c1c(=O)n2)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 C23H15N3O5S2 MW 477.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H15N3O5S2/c27-20-19-15-3-1-2-4-17(15)32-22(19)25-21(28)18(33-23(25)24-20)11-14-9-10-16(31-14)12-5-7-13(8-6-12)26(29)30/h5-11H,1-4H2/b18-11-InChIKey
RLVIRUULERDRBG-WQRHYEAKSA-NSynonyms
(2Z)2((5(4nitrophenyl)furan2yl)methylidene)6789tetrahydro5H(1)benzothieno(32e)(13)thiazolo(32a)pyrimidine15(2H)dione
(O)(N+)(=O)c1ccc(cc1)c1ccc(o1)C=c1sc2n(c1=O)c1sc3c(c1c(=O)n2)CCCC3
C1CCC2=C(C1)C3=C(S2)N4C(=O)C(=CC5=CC=C(O5)C6=CC=C(C=C6)(N+)(=O)(O))SC4=NC3=O
InChI=1SC23H15N3O5S2c27201915312417(15)3222(19)2521(28)18(3323(25)2420)111491016(3114)125713(8612)26(29)30h511H14H2b1811
MFCD03018084
ZINC000003617916
ZINC03617916
ZINC3617916
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