Vitas-M small molecule compound
2-[(3-amino-1H-1,2,4-triazol-5-yl)sulfanyl]-N-[4-(azepan-1-ylsulfonyl)phenyl]acetamide
Catalog ID
STL373758
SMILES O=C(Nc1ccc(cc1)S(=O)(=O)N1CCCCCC1)CSc1[nH]nc(n1)N
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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 C16H22N6O3S2 MW 410.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22N6O3S2/c17-15-19-16(21-20-15)26-11-14(23)18-12-5-7-13(8-6-12)27(24,25)22-9-3-1-2-4-10-22/h5-8H,1-4,9-11H2,(H,18,23)(H3,17,19,20,21)InChIKey
SMMIPNAAFWOGDZ-UHFFFAOYSA-NSynonyms
932142-96-62((3amino1H124triazol5yl)sulfanyl)N(4(azepan1ylsulfonyl)phenyl)acetamide
2((5amino1H124triazol3yl)sulfanyl)N(4(azepan1ylsulfonyl)phenyl)acetamide
932142966
C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CSC3=NNC(=N3)N
InChI=1SC16H22N6O3S2c17151916(212015)261114(23)18125713(8612)27(2425)22931241022h58H14911H2(H1823)(H317192021)
MFCD28165786
O=C(Nc1ccc(cc1)S(=O)(=O)N1CCCCCC1)CSc1(nH)nc(n1)N
ZINC000014164291
ZINC14164291
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