Vitas-M small molecule compound
3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g]chromen-3-yl)-N-(4H-1,2,4-triazol-3-yl)propanamide
Catalog ID
STL349937
SMILES O=C(Nc1nnc[nH]1)CCc1c(=O)oc2c(c1C)cc1c(c2)oc2c1CCCC2
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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 C21H20N4O4 MW 392.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O4/c1-11-12(6-7-19(26)24-21-22-10-23-25-21)20(27)29-17-9-18-15(8-14(11)17)13-4-2-3-5-16(13)28-18/h8-10H,2-7H2,1H3,(H2,22,23,24,25,26)InChIKey
PWDGYRMNLJZGQO-UHFFFAOYSA-NSynonyms
921160-05-63(4methyl2oxo6789tetrahydro(1)benzofuro(32g)chromen3yl)N(1H124triazol5yl)propanamide
3(4methyl2oxo6789tetrahydro2H(1)benzofuro(32g)chromen3yl)N(4H124triazol3yl)propanamide
3(4methyl2oxo6789tetrahydro2Hbenzofuro(32g)chromen3yl)N(4H124triazol3yl)propanamide
921160056
CC1=C(C(=O)OC2=C1C=C3C4=C(CCCC4)OC3=C2)CCC(=O)NC5=NC=NN5
InChI=1SC21H20N4O4c11112(6719(26)24212210232521)20(27)291791815(814(11)17)13423516(13)2818h810H27H21H3(H22223242526)
MFCD08744562
O=C(Nc1nnc(nH)1)CCc1c(=O)oc2c(c1C)cc1c(c2)oc2c1CCCC2
ZINC000013624609
ZINC13624609
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