Vitas-M small molecule compound
N-({4-methyl-5-[(2-oxo-2-{[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]amino}ethyl)sulfanyl]-4H-1,2,4-triazol-3-yl}methyl)furan-2-carboxamide
Catalog ID
STK297366
SMILES O=C(Nc1nnc(s1)C(C)C)CSc1nnc(n1C)CNC(=O)c1ccco1
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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 C16H19N7O3S2 MW 421.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19N7O3S2/c1-9(2)14-20-21-15(28-14)18-12(24)8-27-16-22-19-11(23(16)3)7-17-13(25)10-5-4-6-26-10/h4-6,9H,7-8H2,1-3H3,(H,17,25)(H,18,21,24)InChIKey
GYLLTXJMJYCAJJ-UHFFFAOYSA-NSynonyms
CC(C)C1=NN=C(S1)NC(=O)CSC2=NN=C(N2C)CNC(=O)C3=CC=CO3
FURAN2CARBOXYLICACID(5((5ISOPROPYL(134)THIADIAZOL2YLCARBAMOYL)METHYLSULFANYL)4METHYL4H(124)TRIAZOL3YLMETHYL)AMIDE
InChI=1SC16H19N7O3S2c19(2)14202115(2814)1812(24)82716221911(23(16)3)71713(25)105462610h469H78H213H3(H1725)(H182124)
MFCD09960945
N((4methyl5((2oxo2((5(propan2yl)134thiadiazol2yl)amino)ethyl)sulfanyl)4H124triazol3yl)methyl)furan2carboxamide
N((4methyl5(2oxo2((5propan2yl134thiadiazol2yl)amino)ethyl)sulfanyl124triazol3yl)methyl)furan2carboxamide
ZINC000013956335
ZINC13956335
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