Vitas-M small molecule compound
4-chloro-N-[(6-methyl-2-phenyl-2H-benzotriazol-5-yl)carbamothioyl]butanamide
Catalog ID
STK243832
SMILES ClCCCC(=O)NC(=S)Nc1cc2nn(nc2cc1C)c1ccccc1
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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 C18H18ClN5OS MW 387.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClN5OS/c1-12-10-15-16(23-24(22-15)13-6-3-2-4-7-13)11-14(12)20-18(26)21-17(25)8-5-9-19/h2-4,6-7,10-11H,5,8-9H2,1H3,(H2,20,21,25,26)InChIKey
BOQHAGXQSYENQW-UHFFFAOYSA-NSynonyms
532937-84-14chloroN((6methyl2phenyl2Hbenzo(d)(123)triazol5yl)carbamothioyl)butanamide
4chloroN((6methyl2phenyl2Hbenzotriazol5yl)carbamothioyl)butanamide
4CHLORON((6METHYL2PHENYLBENZOTRIAZOL5YL)CARBAMOTHIOYL)BUTANAMIDE
532937841
CC1=CC2=NN(N=C2C=C1NC(=S)NC(=O)CCCCl)C3=CC=CC=C3
InChI=1SC18H18ClN5OSc112101516(2324(2215)136324713)1114(12)2018(26)2117(25)85919h24671011H589H21H3(H220212526)
MFCD03568507
ZINC000002232363
ZINC02232363
ZINC2232363
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