Vitas-M small molecule compound
(2E)-4-[(3-cyano-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-4-oxobut-2-enoic acid
Catalog ID
STK283300
SMILES N#Cc1c(NC(=O)/C=C/C(=O)O)sc2c1CC(C)CC2
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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 C14H14N2O3S MW 290.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H14N2O3S/c1-8-2-3-11-9(6-8)10(7-15)14(20-11)16-12(17)4-5-13(18)19/h4-5,8H,2-3,6H2,1H3,(H,16,17)(H,18,19)/b5-4+InChIKey
XMDWZNAVROTHED-SNAWJCMRSA-NSynonyms
374919-53-6(2E)4((3cyano5methyl4567tetrahydro1benzothiophen2yl)amino)4oxobut2enoicacid
(E)4((3cyano5methyl4567tetrahydro1benzothiophen2yl)amino)4oxobut2enoicacid
(E)4((3cyano5methyl4567tetrahydrobenzo(b)thiophen2yl)amino)4oxobut2enoicacid
374919536
CC1CCC2=C(C1)C(=C(S2)NC(=O)C=CC(=O)O)C#N
InChI=1SC14H14N2O3Sc1823119(68)10(715)14(2011)1612(17)4513(18)19h458H236H21H3(H1617)(H1819)b54+
MFCD02236415
N#Cc1c(NC(=O)C=CC(=O)O)sc2c1CC(C)CC2
ZINC000001901744
ZINC000001901745
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