Vitas-M small molecule compound
N'-[(E)-(3-bromophenyl)methylidene]-2-({5-[(naphthalen-1-ylamino)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)propanehydrazide
Catalog ID
STL171412
SMILES C=CCn1c(nnc1CNc1cccc2c1cccc2)SC(C(=O)N/N=C/c1cccc(c1)Br)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 C26H25BrN6OS MW 549.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25BrN6OS/c1-3-14-33-24(17-28-23-13-7-10-20-9-4-5-12-22(20)23)30-32-26(33)35-18(2)25(34)31-29-16-19-8-6-11-21(27)15-19/h3-13,15-16,18,28H,1,14,17H2,2H3,(H,31,34)/b29-16+InChIKey
QJYQRHDUZQHUAS-MUFRIFMGSA-NSynonyms
570418-40-5570418405
C=CCn1c(nnc1CNc1cccc2c1cccc2)SC(C(=O)NN=Cc1cccc(c1)Br)C
CC(C(=O)NN=CC1=CC(=CC=C1)Br)SC2=NN=C(N2CC=C)CNC3=CC=CC4=CC=CC=C43
InChI=1SC26H25BrN6OSc13143324(17282313710209451222(20)23)303226(33)3518(2)25(34)31291619861121(27)1519h31315161828H11417H22H3(H3134)b2916+
MFCD01437253
N((E)(3bromophenyl)methylidene)2((5((naphthalen1ylamino)methyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)propanehydrazide
N((E)(3bromophenyl)methylideneamino)2((5((naphthalen1ylamino)methyl)4prop2enyl124triazol3yl)sulfanyl)propanamide
ZINC000002743188
ZINC000002743190
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