Vitas-M small molecule compound
2-{5-[(2-amino-2-oxoethyl)sulfanyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}-N-(3-chloro-4-methylphenyl)acetamide
Catalog ID
STK297482
SMILES C=CCn1c(nnc1SCC(=O)N)CC(=O)Nc1ccc(c(c1)Cl)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 C16H18ClN5O2S MW 379.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18ClN5O2S/c1-3-6-22-14(20-21-16(22)25-9-13(18)23)8-15(24)19-11-5-4-10(2)12(17)7-11/h3-5,7H,1,6,8-9H2,2H3,(H2,18,23)(H,19,24)InChIKey
QOWUJLGUNSSIIO-UHFFFAOYSA-NSynonyms
2(4ALLYL5((3CHLORO4METHYLPHENYLCARBAMOYL)METHYL)4H(124)TRIAZOL3YLSULFANYL)ACETAMIDE
2(5((2amino2oxoethyl)sulfanyl)4(prop2en1yl)4H124triazol3yl)N(3chloro4methylphenyl)acetamide
2(5(2amino2oxoethyl)sulfanyl4prop2enyl124triazol3yl)N(3chloro4methylphenyl)acetamide
CC1=C(C=C(C=C1)NC(=O)CC2=NN=C(N2CC=C)SCC(=O)N)Cl
InChI=1SC16H18ClN5O2Sc1362214(202116(22)25913(18)23)815(24)19115410(2)12(17)711h357H1689H22H3(H21823)(H1924)
MFCD09876756
ZINC000008784673
ZINC08784673
ZINC8784673
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