Vitas-M small molecule compound
ethyl (2Z)-2-[(5-methylfuran-2-yl)methylidene]-3-oxo-7-phenyl-5-[4-(propan-2-yl)phenyl]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK100476
SMILES CCOC(=O)C1=C(N=c2n(C1c1ccc(cc1)C(C)C)c(=O)/c(=C/c1ccc(o1)C)/s2)c1ccccc1
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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 C30H28N2O4S MW 512.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28N2O4S/c1-5-35-29(34)25-26(21-9-7-6-8-10-21)31-30-32(27(25)22-14-12-20(13-15-22)18(2)3)28(33)24(37-30)17-23-16-11-19(4)36-23/h6-18,27H,5H2,1-4H3/b24-17-InChIKey
WTAIGCVLFXPDBW-ULJHMMPZSA-NSynonyms
CCOC(=O)C1=C(N=c2n(C1c1ccc(cc1)C(C)C)c(=O)c(=Cc1ccc(o1)C)s2)c1ccccc1
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)C(C)C)C(=O)C(=CC4=CC=C(O4)C)S2)C5=CC=CC=C5
ETHYL(2Z)2((5METHYLFURAN2YL)METHYLIDENE)3OXO7PHENYL5(4(PROPAN2YL)PHENYL)23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL(2Z)2((5METHYLFURAN2YL)METHYLIDENE)3OXO7PHENYL5(4PROPAN2YLPHENYL)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC30H28N2O4Sc153529(34)2526(2197681021)313032(27(25)22141220(131522)18(2)3)28(33)24(3730)1723161119(4)3623h61827H5H214H3b2417
MFCD02191164
ZINC000009762313
ZINC000013896388
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