Vitas-M small molecule compound
N-[5-({2-[(4-methoxy-2-nitrophenyl)amino]-2-oxoethyl}sulfanyl)-1,3,4-thiadiazol-2-yl]-3-methylbenzamide
Catalog ID
STK232937
SMILES COc1ccc(c(c1)[N+](=O)[O-])NC(=O)CSc1nnc(s1)NC(=O)c1cccc(c1)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 C19H17N5O5S2 MW 459.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N5O5S2/c1-11-4-3-5-12(8-11)17(26)21-18-22-23-19(31-18)30-10-16(25)20-14-7-6-13(29-2)9-15(14)24(27)28/h3-9H,10H2,1-2H3,(H,20,25)(H,21,22,26)InChIKey
YYWYNHSOYQUZRU-UHFFFAOYSA-NSynonyms
CC1=CC=CC(=C1)C(=O)NC2=NN=C(S2)SCC(=O)NC3=C(C=C(C=C3)OC)(N+)(=O)(O)
COc1ccc(c(c1)(N+)(=O)(O))NC(=O)CSc1nnc(s1)NC(=O)c1cccc(c1)C
InChI=1SC19H17N5O5S2c11143512(811)17(26)2118222319(3118)301016(25)20147613(292)915(14)24(27)28h39H10H212H3(H2025)(H212226)
MFCD03995212
N(5((2((4METHOXY2NITROPHENYL)AMINO)2OXOETHYL)SULFANYL)134THIADIAZOL2YL)3METHYLBENZAMIDE
N(5(2(4METHOXY2NITROANILINO)2OXOETHYL)SULFANYL134THIADIAZOL2YL)3METHYLBENZAMIDE
ZINC000013839471
ZINC13839471
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