Vitas-M small molecule compound
4-{2-[(3-methylphenyl)carbamothioyl]hydrazinyl}-4-oxobutanoic acid
Catalog ID
STK002791
SMILES O=C(CCC(=O)O)NNC(=S)Nc1cccc(c1)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 C12H15N3O3S MW 281.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H15N3O3S/c1-8-3-2-4-9(7-8)13-12(19)15-14-10(16)5-6-11(17)18/h2-4,7H,5-6H2,1H3,(H,14,16)(H,17,18)(H2,13,15,19)InChIKey
KBRYPJMGIRMGAO-UHFFFAOYSA-NSynonyms
314279-55-53(N((((3METHYLPHENYL)AMINO)THIOXOMETHYL)AMINO)CARBAMOYL)PROPANOICACID
314279555
4(2((3METHYLPHENYL)CARBAMOTHIOYL)HYDRAZINYL)4OXOBUTANOICACID
4OXO4(2(3TOLUIDINOCARBOTHIOYL)HYDRAZINO)BUTANOICACID
CC1=CC(=CC=C1)NC(=S)NNC(=O)CCC(=O)O
InChI=1SC12H15N3O3Sc183249(78)1312(19)151410(16)5611(17)18h247H56H21H3(H1416)(H1718)(H2131519)
MFCD00585271
O=C(CCC(=O)O)NNC(=S)Nc1cccc(c1)C
STK002791
ZINC000002133326
ZINC2133326
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