Vitas-M small molecule compound
N-(4-methyl-3-nitrophenyl)-2-{[5-(morpholin-4-ylmethyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STK343828
SMILES C=CCn1c(SCC(=O)Nc2ccc(c(c2)[N+](=O)[O-])C)nnc1CN1CCOCC1
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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 C19H24N6O4S MW 432.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H24N6O4S/c1-3-6-24-17(12-23-7-9-29-10-8-23)21-22-19(24)30-13-18(26)20-15-5-4-14(2)16(11-15)25(27)28/h3-5,11H,1,6-10,12-13H2,2H3,(H,20,26)InChIKey
VFGQETMXPGAPGT-UHFFFAOYSA-NSynonyms
C=CCn1c(SCC(=O)Nc2ccc(c(c2)(N+)(=O)(O))C)nnc1CN1CCOCC1
CC1=C(C=C(C=C1)NC(=O)CSC2=NN=C(N2CC=C)CN3CCOCC3)(N+)(=O)(O)
InChI=1SC19H24N6O4Sc1362417(1223792910823)212219(24)301318(26)20155414(2)16(1115)25(27)28h3511H16101213H22H3(H2026)
MFCD09964891
N(4METHYL3NITROPHENYL)2((5(MORPHOLIN4YLMETHYL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(4methyl3nitrophenyl)2((5(morpholin4ylmethyl)4prop2enyl124triazol3yl)sulfanyl)acetamide
ZINC000012851187
ZINC12851187
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