Vitas-M small molecule compound
N-[(2Z)-5-(methoxymethyl)-1,3,4-thiadiazol-2(3H)-ylidene]-4-(4-oxo-2-phenyl-1,4-dihydroquinazolin-3(2H)-yl)butanamide
Catalog ID
STL159531
SMILES COCc1n[nH]/c(=N/C(=O)CCCN2C(Nc3c(C2=O)cccc3)c2ccccc2)/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 C22H23N5O3S MW 437.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N5O3S/c1-30-14-19-25-26-22(31-19)24-18(28)12-7-13-27-20(15-8-3-2-4-9-15)23-17-11-6-5-10-16(17)21(27)29/h2-6,8-11,20,23H,7,12-14H2,1H3,(H,24,26,28)InChIKey
BVBIYYUNQSOYAR-UHFFFAOYSA-NSynonyms
1282132-97-11282132971
COCC1=NN=C(S1)NC(=O)CCCN2C(NC3=CC=CC=C3C2=O)C4=CC=CC=C4
COCc1n(nH)c(=NC(=O)CCCN2C(Nc3c(C2=O)cccc3)c2ccccc2)s1
InChI=1SC22H23N5O3Sc1301419252622(3119)2418(28)127132720(158324915)231711651016(17)21(27)29h268112023H71214H21H3(H242628)
MFCD20758714
N((2Z)5(methoxymethyl)134thiadiazol2(3H)ylidene)4(4oxo2phenyl14dihydroquinazolin3(2H)yl)butanamide
N(5(methoxymethyl)134thiadiazol2yl)4(4oxo2phenyl12dihydroquinazolin3yl)butanamide
ZINC000061720935
ZINC000061720936
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