Vitas-M small molecule compound
(2Z)-2-{[4-(1H-indol-4-ylamino)-4-oxobutanoyl]imino}-5-(2-methylpropyl)-2,3-dihydro-1,3-thiazole-4-carboxylic acid
Catalog ID
STL309339
SMILES CC(Cc1s/c(=N\C(=O)CCC(=O)Nc2cccc3c2cc[nH]3)/[nH]c1C(=O)O)C
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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 C20H22N4O4S MW 414.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O4S/c1-11(2)10-15-18(19(27)28)24-20(29-15)23-17(26)7-6-16(25)22-14-5-3-4-13-12(14)8-9-21-13/h3-5,8-9,11,21H,6-7,10H2,1-2H3,(H,22,25)(H,27,28)(H,23,24,26)InChIKey
VZFWOQBSZXKDCM-UHFFFAOYSA-NSynonyms
1436004-21-5(2Z)2((4(1Hindol4ylamino)4oxobutanoyl)imino)5(2methylpropyl)23dihydro13thiazole4carboxylicacid
1436004215
2((4(1Hindol4ylamino)4oxobutanoyl)amino)5(2methylpropyl)13thiazole4carboxylicacid
CC(C)CC1=C(N=C(S1)NC(=O)CCC(=O)NC2=CC=CC3=C2C=CN3)C(=O)O
CC(Cc1sc(=NC(=O)CCC(=O)Nc2cccc3c2cc(nH)3)(nH)c1C(=O)O)C
InChI=1SC20H22N4O4Sc111(2)101518(19(27)28)2420(2915)2317(26)7616(25)22145341312(14)892113h35891121H6710H212H3(H2225)(H2728)(H232426)
MFCD28028873
ZINC000095472499
ZINC95472499
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