Vitas-M small molecule compound
5-amino-N-(2-{[(1E)-1-(2,4,6-trioxo-1,3-thiazinan-5-ylidene)ethyl]amino}ethyl)-4H-1,2,4-triazole-3-carboxamide
Catalog ID
STL181286
SMILES O=C1NC(=O)/C(=C(\NCCNC(=O)c2nnc([nH]2)N)/C)/C(=O)S1
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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 C11H13N7O4S MW 339.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H13N7O4S/c1-4(5-7(19)16-11(22)23-9(5)21)13-2-3-14-8(20)6-15-10(12)18-17-6/h13H,2-3H2,1H3,(H,14,20)(H,16,19,22)(H3,12,15,17,18)/b5-4+InChIKey
UWJLCQLCQGOZIF-SNAWJCMRSA-NSynonyms
1174905-94-2(5AMINO(4H124TRIAZOL3YL))N(2(((246TRIOXO(13THIAZAPERHYDROIN5YLIDENE))ETHYL)AMINO)ETHYL)CARBOXAMIDE
1174905942
3aminoN(2(((1E)1(246trioxo13thiazinan5ylidene)ethyl)amino)ethyl)1H124triazole5carboxamide
5aminoN(2(((1E)1(246trioxo13thiazinan5ylidene)ethyl)amino)ethyl)4H124triazole3carboxamide
CC(=C1C(=O)NC(=O)SC1=O)NCCNC(=O)C2=NC(=NN2)N
InChI=1SC11H13N7O4Sc14(57(19)1611(22)239(5)21)1323148(20)61510(12)18176h13H23H21H3(H1420)(H161922)(H312151718)b54+
MFCD12025603
O=C1NC(=O)C(=C(NCCNC(=O)c2nnc((nH)2)N)C)C(=O)S1
ZINC000101152015
ZINC101152015
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