Vitas-M small molecule compound
2-[(5-{[(4-chloro-2-methylphenyl)amino]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N'-[1-(naphthalen-2-yl)ethylidene]propanehydrazide
Catalog ID
STL171193
SMILES O=C(C(Sc1nnc(n1c1ccccc1)CNc1ccc(cc1C)Cl)C)N/N=C(/c1ccc2c(c1)cccc2)\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 C31H29ClN6OS MW 569.13 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29ClN6OS/c1-20-17-26(32)15-16-28(20)33-19-29-35-37-31(38(29)27-11-5-4-6-12-27)40-22(3)30(39)36-34-21(2)24-14-13-23-9-7-8-10-25(23)18-24/h4-18,22,33H,19H2,1-3H3,(H,36,39)InChIKey
YKBDCHMVQWCOGL-UHFFFAOYSA-NSynonyms
769166-91-82((5(((4chloro2methylphenyl)amino)methyl)4phenyl4H124triazol3yl)sulfanyl)N(1(naphthalen2yl)ethylidene)propanehydrazide
2((5((4chloro2methylanilino)methyl)4phenyl124triazol3yl)sulfanyl)N(1naphthalen2ylethylideneamino)propanamide
769166918
CC1=C(C=CC(=C1)Cl)NCC2=NN=C(N2C3=CC=CC=C3)SC(C)C(=O)NN=C(C)C4=CC5=CC=CC=C5C=C4
InChI=1SC31H29ClN6OSc1201726(32)151628(20)331929353731(38(29)27115461227)4022(3)30(39)363421(2)241413239781025(23)1824h4182233H19H213H3(H3639)
MFCD01432959
O=C(C(Sc1nnc(n1c1ccccc1)CNc1ccc(cc1C)Cl)C)NN=C(c1ccc2c(c1)cccc2)C
ZINC000252428328
ZINC000252428329
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