Vitas-M small molecule compound
N-{[2-methyl-5-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]carbamothioyl}-5-(2-nitrophenyl)furan-2-carboxamide
Catalog ID
STK199505
SMILES S=C(Nc1cc(ccc1C)c1sc2n(n1)c(nn2)C)NC(=O)c1ccc(o1)c1ccccc1[N+](=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 C23H17N7O4S2 MW 519.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17N7O4S2/c1-12-7-8-14(21-28-29-13(2)26-27-23(29)36-21)11-16(12)24-22(35)25-20(31)19-10-9-18(34-19)15-5-3-4-6-17(15)30(32)33/h3-11H,1-2H3,(H2,24,25,31,35)InChIKey
HASGQOQCXIYQRP-UHFFFAOYSA-NSynonyms
CC1=C(C=C(C=C1)C2=NN3C(=NN=C3S2)C)NC(=S)NC(=O)C4=CC=C(O4)C5=CC=CC=C5(N+)(=O)(O)
InChI=1SC23H17N7O4S2c1127814(21282913(2)262723(29)3621)1116(12)2422(35)2520(31)1910918(3419)15534617(15)30(32)33h311H12H3(H224253135)
MFCD06666169
N((2METHYL5(3METHYL(124)TRIAZOLO(34B)(134)THIADIAZOL6YL)PHENYL)CARBAMOTHIOYL)5(2NITROPHENYL)FURAN2CARBOXAMIDE
S=C(Nc1cc(ccc1C)c1sc2n(n1)c(nn2)C)NC(=O)c1ccc(o1)c1ccccc1(N+)(=O)(O)
ZINC000100385717
ZINC100385717
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