Vitas-M small molecule compound
4-chloro-N-{[6-chloro-2-(4-methylphenyl)-2H-benzotriazol-5-yl]carbamothioyl}butanamide
Catalog ID
STK029952
SMILES ClCCCC(=O)NC(=S)Nc1cc2nn(nc2cc1Cl)c1ccc(cc1)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 C18H17Cl2N5OS MW 422.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17Cl2N5OS/c1-11-4-6-12(7-5-11)25-23-15-9-13(20)14(10-16(15)24-25)21-18(27)22-17(26)3-2-8-19/h4-7,9-10H,2-3,8H2,1H3,(H2,21,22,26,27)InChIKey
LQQVCJBRBMBDDZ-UHFFFAOYSA-NSynonyms
535958-33-94CHLORON((6CHLORO2(4METHYLPHENYL)2HBENZOTRIAZOL5YL)CARBAMOTHIOYL)BUTANAMIDE
4CHLORON((6CHLORO2(4METHYLPHENYL)BENZOTRIAZOL5YL)CARBAMOTHIOYL)BUTANAMIDE
4chloroN((6chloro2(ptolyl)2Hbenzo(d)(123)triazol5yl)carbamothioyl)butanamide
535958339
CC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)Cl)NC(=S)NC(=O)CCCCl
ClCCCC(=O)NC(=S)Nc1cc2nn(nc2cc1Cl)c1ccc(cc1)C
InChI=1SC18H17Cl2N5OSc1114612(7511)252315913(20)14(1016(15)2425)2118(27)2217(26)32819h47910H238H21H3(H221222627)
MFCD03572530
STK029952
ZINC000002209493
ZINC02209493
ZINC2209493
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