Vitas-M small molecule compound
3-methyl-N-[(4-methyl-5-{[2-oxo-2-(1,3,4-thiadiazol-2-ylamino)ethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)methyl]benzamide
Catalog ID
STK221974
SMILES O=C(Nc1scnn1)CSc1nnc(n1C)CNC(=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 C16H17N7O2S2 MW 403.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N7O2S2/c1-10-4-3-5-11(6-10)14(25)17-7-12-20-22-16(23(12)2)26-8-13(24)19-15-21-18-9-27-15/h3-6,9H,7-8H2,1-2H3,(H,17,25)(H,19,21,24)InChIKey
NFLPBTOGPKEOPW-UHFFFAOYSA-NSynonyms
3methylN((4methyl5((2oxo2(134thiadiazol2ylamino)ethyl)sulfanyl)4H124triazol3yl)methyl)benzamide
3METHYLN((4METHYL5(2OXO2(134THIADIAZOL2YLAMINO)ETHYL)SULFANYL124TRIAZOL3YL)METHYL)BENZAMIDE
3METHYLN(4METHYL5((134)THIADIAZOL2YLCARBAMOYLMETHYLSULFANYL)4H(124)TRIAZOL3YLMETHYL)BENZAMIDE
CC1=CC=CC(=C1)C(=O)NCC2=NN=C(N2C)SCC(=O)NC3=NN=CS3
InChI=1SC16H17N7O2S2c11043511(610)14(25)17712202216(23(12)2)26813(24)1915211892715h369H78H212H3(H1725)(H192124)
MFCD07401358
ZINC000009303311
ZINC09303311
ZINC9303311
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