Vitas-M small molecule compound
2-({[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)-N-(4-chlorophenyl)hydrazinecarbothioamide
Catalog ID
STK106593
SMILES O=C(CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)C(C)(C)C)NNC(=S)Nc1ccc(cc1)Cl
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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 C28H29ClN6OS2 MW 565.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29ClN6OS2/c1-18-5-15-23(16-6-18)35-25(19-7-9-20(10-8-19)28(2,3)4)32-34-27(35)38-17-24(36)31-33-26(37)30-22-13-11-21(29)12-14-22/h5-16H,17H2,1-4H3,(H,31,36)(H2,30,33,37)InChIKey
IZYMTEDFGGTFMW-UHFFFAOYSA-NSynonyms
1((2((5(4TERTBUTYLPHENYL)4(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)3(4CHLOROPHENYL)THIOUREA
2(((5(4TERTBUTYLPHENYL)4(4METHYLPHENYL)4H124TRIAZOL3YL)SULFANYL)ACETYL)N(4CHLOROPHENYL)HYDRAZINECARBOTHIOAMIDE
2(5(4(TERTBUTYL)PHENYL)4(4METHYLPHENYL)(124TRIAZOL3YLTHIO))N((((4CHLOROPHENYL)AMINO)THIOXOMETHYL)AMINO)ACETAMIDE
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NNC(=S)NC3=CC=C(C=C3)Cl)C4=CC=C(C=C4)C(C)(C)C
InChI=1SC28H29ClN6OS2c11851523(16618)3525(197920(10819)28(23)4)323427(35)381724(36)313326(37)3022131121(29)121422h516H17H214H3(H3136)(H2303337)
MFCD03219873
ZINC000002696141
ZINC2696141
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