Vitas-M small molecule compound
6'-(1,3-benzodioxol-5-ylcarbonyl)-5-methoxy-7'-phenyl-1',6',7',7a'-tetrahydrospiro[indole-3,5'-pyrrolo[1,2-c][1,3]thiazol]-2(1H)-one
Catalog ID
STL058144
SMILES COc1ccc2c(c1)C1(C(=O)N2)C(C(=O)c2ccc3c(c2)OCO3)C(C2N1CSC2)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 C28H24N2O5S MW 500.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24N2O5S/c1-33-18-8-9-20-19(12-18)28(27(32)29-20)25(26(31)17-7-10-22-23(11-17)35-15-34-22)24(16-5-3-2-4-6-16)21-13-36-14-30(21)28/h2-12,21,24-25H,13-15H2,1H3,(H,29,32)InChIKey
SAPCYIFYVZWQFD-UHFFFAOYSA-NSynonyms
(3S)6(benzo(d)(13)dioxole5carbonyl)5methoxy7phenyl3677atetrahydro1Hspiro(indoline35pyrrolo(12c)thiazol)2one
6(13benzodioxol5ylcarbonyl)5methoxy7phenyl1677atetrahydrospiro(indole35pyrrolo(12c)(13)thiazol)2(1H)one
6(13benzodioxole5carbonyl)5methoxy7phenylspiro(1Hindole353677atetrahydro1Hpyrrolo(12c)(13)thiazole)2one
COC1=CC2=C(C=C1)NC(=O)C23C(C(C4N3CSC4)C5=CC=CC=C5)C(=O)C6=CC7=C(C=C6)OCO7
COc1ccc2c(c1)(C@)1(C(=O)N2)C(C(=O)c2ccc3c(c2)OCO3)C(C2N1CSC2)c1ccccc1
InChI=1SC28H24N2O5Sc13318892019(1218)28(27(32)2920)25(26(31)177102223(1117)35153422)24(165324616)2113361430(21)28h212212425H1315H21H3(H2932)
MFCD18192922
ZINC000013541630
ZINC000035374743
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