Vitas-M small molecule compound
3-[4-amino-3-({2-[(3-methylphenyl)amino]-2-oxoethyl}sulfanyl)-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl]propanoic acid
Catalog ID
STK678468
SMILES O=C(Nc1cccc(c1)C)CSc1nnc(c(=O)n1N)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 C15H17N5O4S MW 363.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H17N5O4S/c1-9-3-2-4-10(7-9)17-12(21)8-25-15-19-18-11(5-6-13(22)23)14(24)20(15)16/h2-4,7H,5-6,8,16H2,1H3,(H,17,21)(H,22,23)InChIKey
ZSVOJXOJQXRHTH-UHFFFAOYSA-NSynonyms
3(4amino3((2((3methylphenyl)amino)2oxoethyl)sulfanyl)5oxo45dihydro124triazin6yl)propanoicacid
3(4AMINO3((2((3METHYLPHENYL)AMINO)2OXOETHYL)THIO)5OXO45DIHYDRO124TRIAZIN6YL)PROPANOICACID
3(4AMINO3(2(3METHYLANILINO)2OXOETHYL)SULFANYL5OXO124TRIAZIN6YL)PROPANOICACID
CC1=CC(=CC=C1)NC(=O)CSC2=NN=C(C(=O)N2N)CCC(=O)O
InChI=1SC15H17N5O4Sc1932410(79)1712(21)82515191811(5613(22)23)14(24)20(15)16h247H56816H21H3(H1721)(H2223)
MFCD03133560
ZINC000003618558
ZINC3618558
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