Vitas-M small molecule compound
N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-{[5-(morpholin-4-ylmethyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STK346588
SMILES C=CCn1c(SCC(=O)Nc2c(C)n(n(c2=O)c2ccccc2)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 C23H29N7O3S MW 483.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29N7O3S/c1-4-10-29-19(15-28-11-13-33-14-12-28)25-26-23(29)34-16-20(31)24-21-17(2)27(3)30(22(21)32)18-8-6-5-7-9-18/h4-9H,1,10-16H2,2-3H3,(H,24,31)InChIKey
FWCSEGQKRFDRQO-UHFFFAOYSA-NSynonyms
CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CSC3=NN=C(N3CC=C)CN4CCOCC4
InChI=1SC23H29N7O3Sc14102919(1528111333141228)252623(29)341620(31)242117(2)27(3)30(22(21)32)188657918h49H11016H223H3(H2431)
MFCD11851377
N(15DIMETHYL3OXO2PHENYL23DIHYDRO1HPYRAZOL4YL)2((5(MORPHOLIN4YLMETHYL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(15dimethyl3oxo2phenylpyrazol4yl)2((5(morpholin4ylmethyl)4prop2enyl124triazol3yl)sulfanyl)acetamide
ZINC000012859895
ZINC12859895
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