Vitas-M small molecule compound
N-{[5-({1-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-1-oxopropan-2-yl}sulfanyl)-4-ethyl-4H-1,2,4-triazol-3-yl]methyl}-2-methoxybenzamide
Catalog ID
STK246283
SMILES CCn1c(nnc1CNC(=O)c1ccccc1OC)SC(C(=O)Nc1sc(c(n1)C)C)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 C21H26N6O3S2 MW 474.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N6O3S2/c1-6-27-17(11-22-19(29)15-9-7-8-10-16(15)30-5)25-26-21(27)32-14(4)18(28)24-20-23-12(2)13(3)31-20/h7-10,14H,6,11H2,1-5H3,(H,22,29)(H,23,24,28)InChIKey
IIIDAAIQMOAMCA-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SC(C)C(=O)NC2=NC(=C(S2)C)C)CNC(=O)C3=CC=CC=C3OC
InChI=1SC21H26N6O3S2c162717(112219(29)159781016(15)305)252621(27)3214(4)18(28)24202312(2)13(3)3120h71014H611H215H3(H2229)(H232428)
MFCD08683931
N((5((1((45dimethyl13thiazol2yl)amino)1oxopropan2yl)sulfanyl)4ethyl4H124triazol3yl)methyl)2methoxybenzamide
N((5(1((45dimethyl13thiazol2yl)amino)1oxopropan2yl)sulfanyl4ethyl124triazol3yl)methyl)2methoxybenzamide
N(5(1(45DIMETHYLTHIAZOL2YLCARBAMOYL)ETHYLSULFANYL)4ETHYL4H(124)TRIAZOL3YLMETHYL)2METHOXYBENZAMIDE
ZINC000009329101
ZINC000009329102
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