Vitas-M small molecule compound
methyl 4-{2-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-3,9-dioxo-1,2,3,9-tetrahydrochromeno[2,3-c]pyrrol-1-yl}benzoate
Catalog ID
STK906189
SMILES COC(=O)c1ccc(cc1)C1N(c2nnc(s2)CC(C)C)C(=O)c2c1c(=O)c1c(o2)cccc1
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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 C25H21N3O5S MW 475.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N3O5S/c1-13(2)12-18-26-27-25(34-18)28-20(14-8-10-15(11-9-14)24(31)32-3)19-21(29)16-6-4-5-7-17(16)33-22(19)23(28)30/h4-11,13,20H,12H2,1-3H3InChIKey
MAJYCTSFORREIB-UHFFFAOYSA-NSynonyms
848765-64-0848765640
CC(C)CC1=NN=C(S1)N2C(C3=C(C2=O)OC4=CC=CC=C4C3=O)C5=CC=C(C=C5)C(=O)OC
InChI=1SC25H21N3O5Sc113(2)1218262725(3418)2820(1481015(11914)24(31)323)1921(29)16645717(16)3322(19)23(28)30h4111320H12H213H3
methyl4(2(5(2methylpropyl)134thiadiazol2yl)39dioxo1239tetrahydrochromeno(23c)pyrrol1yl)benzoate
METHYL4(2(5(2METHYLPROPYL)134THIADIAZOL2YL)39DIOXO1HCHROMENO(23C)PYRROL1YL)BENZOATE
methyl4(2(5isobutyl134thiadiazol2yl)39dioxo1239tetrahydrochromeno(23c)pyrrol1yl)benzoate
MFCD04192985
ZINC000002428281
ZINC000002428282
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