Vitas-M small molecule compound
N-[(2Z)-5-(methoxymethyl)-1,3,4-thiadiazol-2(3H)-ylidene]-4-[(4-oxoquinazolin-3(4H)-yl)methyl]cyclohexanecarboxamide
Catalog ID
STL161999
SMILES COCc1n[nH]/c(=N/C(=O)C2CCC(CC2)Cn2cnc3c(c2=O)cccc3)/s1
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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 C20H23N5O3S MW 413.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N5O3S/c1-28-11-17-23-24-20(29-17)22-18(26)14-8-6-13(7-9-14)10-25-12-21-16-5-3-2-4-15(16)19(25)27/h2-5,12-14H,6-11H2,1H3,(H,22,24,26)InChIKey
YVZJPKUMKXPZTK-UHFFFAOYSA-NSynonyms
1282128-49-71282128497
COCC1=NN=C(S1)NC(=O)C2CCC(CC2)CN3C=NC4=CC=CC=C4C3=O
InChI=1SC20H23N5O3Sc1281117232420(2917)2218(26)148613(7914)1025122116532415(16)19(25)27h251214H611H21H3(H222426)
MFCD20759544
N((2Z)5(methoxymethyl)134thiadiazol2(3H)ylidene)4((4oxoquinazolin3(4H)yl)methyl)cyclohexanecarboxamide
N(5(methoxymethyl)134thiadiazol2yl)4((4oxoquinazolin3yl)methyl)cyclohexane1carboxamide
ZINC000061721185
ZINC101701201
ZINC61721185
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