Vitas-M small molecule compound

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

Catalog ID
STK080394
SMILES CCN(c1ccc(cc1)/C=N/NC(=O)CSc1nnc(n1c1ccccc1)c1ccc(cc1)C(C)(C)C)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 C31H36N6OS MW 540.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H36N6OS/c1-6-36(7-2)26-19-13-23(14-20-26)21-32-33-28(38)22-39-30-35-34-29(37(30)27-11-9-8-10-12-27)24-15-17-25(18-16-24)31(3,4)5/h8-21H,6-7,22H2,1-5H3,(H,33,38)/b32-21+
InChIKey
GAOORKJQVDHYLK-RUMWWMSVSA-N
Synonyms
361164-46-7
(E)2((5(4(tertbutyl)phenyl)4phenyl4H124triazol3yl)thio)N(4(diethylamino)benzylidene)acetohydrazide
2((5(4TERTBUTYLPHENYL)4PHENYL124TRIAZOL3YL)SULFANYL)N((E)(4(DIETHYLAMINO)PHENYL)METHYLIDENEAMINO)ACETAMIDE
2((5(4TERTBUTYLPHENYL)4PHENYL4H124TRIAZOL3YL)SULFANYL)N((E)(4(DIETHYLAMINO)PHENYL)METHYLIDENE)ACETOHYDRAZIDE
361164467
CCN(c1ccc(cc1)C=NNC(=O)CSc1nnc(n1c1ccccc1)c1ccc(cc1)C(C)(C)C)CC
CCN(CC)C1=CC=C(C=C1)C=NNC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=C(C=C4)C(C)(C)C
InChI=1SC31H36N6OSc1636(72)26191323(142026)21323328(38)223930353429(37(30)271198101227)24151725(181624)31(34)5h821H6722H215H3(H3338)b3221+
MFCD02641908
N((1E)2(4(DIETHYLAMINO)PHENYL)1AZAVINYL)2(5(4(TERTBUTYL)PHENYL)4PHENYL(124TRIAZOL3YLTHIO))ACETAMIDE
STK080394
ZINC000001817006
ZINC101481754

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Available files

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