Vitas-M small molecule compound

2-{[4,5-bis(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-{(E)-[4-(diethylamino)phenyl]methylidene}acetohydrazide

Catalog ID
STL048177
SMILES CCN(c1ccc(cc1)/C=N/NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1ccc(cc1)Cl)CC

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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 C27H26Cl2N6OS MW 553.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26Cl2N6OS/c1-3-34(4-2)23-13-5-19(6-14-23)17-30-31-25(36)18-37-27-33-32-26(20-7-9-21(28)10-8-20)35(27)24-15-11-22(29)12-16-24/h5-17H,3-4,18H2,1-2H3,(H,31,36)/b30-17+
InChIKey
RLFCXEVGSXLMFK-OCSSWDANSA-N
Synonyms

(E)2((45bis(4chlorophenyl)4H124triazol3yl)thio)N(4(diethylamino)benzylidene)acetohydrazide
2((45BIS(4CHLOROPHENYL)124TRIAZOL3YL)SULFANYL)N((E)(4(DIETHYLAMINO)PHENYL)METHYLIDENEAMINO)ACETAMIDE
2((45bis(4chlorophenyl)4H124triazol3yl)sulfanyl)N((E)(4(diethylamino)phenyl)methylidene)acetohydrazide
CCN(c1ccc(cc1)C=NNC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1ccc(cc1)Cl)CC
CCN(CC)C1=CC=C(C=C1)C=NNC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Cl
InChI=1SC27H26Cl2N6OSc1334(42)2313519(61423)17303125(36)183727333226(207921(28)10820)35(27)24151122(29)121624h517H3418H212H3(H3136)b3017+
MFCD03673429
ZINC000001873070
ZINC100858327

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Available files

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