Vitas-M small molecule compound
4-[(5-methyl-1,3-benzothiazol-2-yl)amino]-4-oxobutanoic acid
Catalog ID
STK370752
SMILES O=C(Nc1nc2c(s1)ccc(c2)C)CCC(=O)O
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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 C12H12N2O3S MW 264.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12N2O3S/c1-7-2-3-9-8(6-7)13-12(18-9)14-10(15)4-5-11(16)17/h2-3,6H,4-5H2,1H3,(H,16,17)(H,13,14,15)InChIKey
HAZKHSMKJVCFFH-UHFFFAOYSA-NSynonyms
3(N(5METHYLBENZOTHIAZOL2YL)CARBAMOYL)PROPANOICACID
4((5methyl13benzothiazol2yl)amino)4oxobutanoicacid
CC1=CC2=C(C=C1)SC(=N2)NC(=O)CCC(=O)O
InChI=1SC12H12N2O3Sc172398(67)1312(189)1410(15)4511(16)17h236H45H21H3(H1617)(H131415)
MFCD00435030
ZINC000000040634
ZINC40634
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