Vitas-M small molecule compound
N'-{(E)-[4-(diethylamino)phenyl]methylidene}-2-({5-[(phenylamino)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)propanehydrazide
Catalog ID
STL171406
SMILES C=CCn1c(nnc1CNc1ccccc1)SC(C(=O)N/N=C/c1ccc(cc1)N(CC)CC)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 C26H33N7OS MW 491.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H33N7OS/c1-5-17-33-24(19-27-22-11-9-8-10-12-22)29-31-26(33)35-20(4)25(34)30-28-18-21-13-15-23(16-14-21)32(6-2)7-3/h5,8-16,18,20,27H,1,6-7,17,19H2,2-4H3,(H,30,34)/b28-18+InChIKey
IBJXERLHBUOKFG-MTDXEUNCSA-NSynonyms
2((4ALLYL5(ANILINOMETHYL)4H124TRIAZOL3YL)SULFANYL)N(4(DIETHYLAMINO)BENZYLIDENE)PROPANOHYDRAZIDE
2((5(anilinomethyl)4prop2enyl124triazol3yl)sulfanyl)N((E)(4(diethylamino)phenyl)methylideneamino)propanamide
C=CCn1c(nnc1CNc1ccccc1)SC(C(=O)NN=Cc1ccc(cc1)N(CC)CC)C
CCN(CC)C1=CC=C(C=C1)C=NNC(=O)C(C)SC2=NN=C(N2CC=C)CNC3=CC=CC=C3
InChI=1SC26H33N7OSc15173324(1927221198101222)293126(33)3520(4)25(34)30281821131523(161421)32(62)73h5816182027H1671719H224H3(H3034)b2818+
MFCD01436912
N((E)(4(diethylamino)phenyl)methylidene)2((5((phenylamino)methyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)propanehydrazide
ZINC000008397092
ZINC000008397100
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