Vitas-M small molecule compound
2-{[5-(3-aminophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-nitrophenyl)acetamide
Catalog ID
STK140509
SMILES CCn1c(SCC(=O)Nc2cccc(c2)[N+](=O)[O-])nnc1c1cccc(c1)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 C18H18N6O3S MW 398.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N6O3S/c1-2-23-17(12-5-3-6-13(19)9-12)21-22-18(23)28-11-16(25)20-14-7-4-8-15(10-14)24(26)27/h3-10H,2,11,19H2,1H3,(H,20,25)InChIKey
GSKHQYSEUQPAMK-UHFFFAOYSA-NSynonyms
2((5(3AMINOPHENYL)4ETHYL124TRIAZOL3YL)SULFANYL)N(3NITROPHENYL)ACETAMIDE
2((5(3AMINOPHENYL)4ETHYL4H124TRIAZOL3YL)SULFANYL)N(3NITROPHENYL)ACETAMIDE
CCN1C(=NN=C1SCC(=O)NC2=CC(=CC=C2)(N+)(=O)(O))C3=CC(=CC=C3)N
CCn1c(SCC(=O)Nc2cccc(c2)(N+)(=O)(O))nnc1c1cccc(c1)N
InChI=1SC18H18N6O3Sc122317(1253613(19)912)212218(23)281116(25)201474815(1014)24(26)27h310H21119H21H3(H2025)
MFCD04332513
ZINC000004678284
ZINC04678284
ZINC4678284
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