Vitas-M small molecule compound
N-[(2Z)-5-methyl-1,3,4-thiadiazol-2(3H)-ylidene]-3-(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanamide
Catalog ID
STL310306
SMILES O=C(/N=c\1/[nH]nc(s1)C)CCc1c(=O)oc2c(c1C)cc1c(c2C)occ1C
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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 C20H19N3O4S MW 397.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N3O4S/c1-9-8-26-17-11(3)18-15(7-14(9)17)10(2)13(19(25)27-18)5-6-16(24)21-20-23-22-12(4)28-20/h7-8H,5-6H2,1-4H3,(H,21,23,24)InChIKey
NAQGAURRRQMILN-UHFFFAOYSA-NSynonyms
1574336-08-51574336085
CC1=COC2=C(C3=C(C=C12)C(=C(C(=O)O3)CCC(=O)NC4=NN=C(S4)C)C)C
InChI=1SC20H19N3O4Sc198261711(3)1815(714(9)17)10(2)13(19(25)2718)5616(24)2120232212(4)2820h78H56H214H3(H212324)
MFCD28025445
N((2Z)5methyl134thiadiazol2(3H)ylidene)3(359trimethyl7oxo7Hfuro(32g)chromen6yl)propanamide
N(5methyl134thiadiazol2yl)3(359trimethyl7oxofuro(32g)chromen6yl)propanamide
O=C(N=c1(nH)nc(s1)C)CCc1c(=O)oc2c(c1C)cc1c(c2C)occ1C
ZINC000095473241
ZINC95473241
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