Vitas-M small molecule compound
4-methoxy-N-[1-(4-methyl-5-{[3-oxo-3-(phenylamino)propyl]sulfanyl}-4H-1,2,4-triazol-3-yl)ethyl]benzamide
Catalog ID
STK197837
SMILES COc1ccc(cc1)C(=O)NC(c1nnc(n1C)SCCC(=O)Nc1ccccc1)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 C22H25N5O3S MW 439.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N5O3S/c1-15(23-21(29)16-9-11-18(30-3)12-10-16)20-25-26-22(27(20)2)31-14-13-19(28)24-17-7-5-4-6-8-17/h4-12,15H,13-14H2,1-3H3,(H,23,29)(H,24,28)InChIKey
RQHWUMIVFDCWNV-UHFFFAOYSA-NSynonyms
4METHOXYN((1R)1(4METHYL5((3OXO3(PHENYLAMINO)PROPYL)SULFANYL)4H124TRIAZOL3YL)ETHYL)BENZAMIDE
4METHOXYN((1S)1(4METHYL5((3OXO3(PHENYLAMINO)PROPYL)SULFANYL)4H124TRIAZOL3YL)ETHYL)BENZAMIDE
4METHOXYN(1(4METHYL5((3OXO3(PHENYLAMINO)PROPYL)SULFANYL)4H124TRIAZOL3YL)ETHYL)BENZAMIDE
CC(C1=NN=C(N1C)SCCC(=O)NC2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)OC
InChI=1SC22H25N5O3Sc115(2321(29)1691118(303)121016)20252622(27(20)2)31141319(28)24177546817h41215H1314H213H3(H2329)(H2428)
MFCD06631388
N(1(5(3ANILINO3OXOPROPYL)SULFANYL4METHYL124TRIAZOL3YL)ETHYL)4METHOXYBENZAMIDE
ZINC000002886123
ZINC000002886124
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