Vitas-M small molecule compound
2-{[5-{[(4-iodophenyl)amino]methyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-naphthalen-2-ylmethylidene]propanehydrazide
Catalog ID
STL171399
SMILES C=CCn1c(nnc1CNc1ccc(cc1)I)SC(C(=O)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 C26H25IN6OS MW 596.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25IN6OS/c1-3-14-33-24(17-28-23-12-10-22(27)11-13-23)30-32-26(33)35-18(2)25(34)31-29-16-19-8-9-20-6-4-5-7-21(20)15-19/h3-13,15-16,18,28H,1,14,17H2,2H3,(H,31,34)/b29-16+InChIKey
GYLDTQNRPKTEJS-MUFRIFMGSA-NSynonyms
570418-30-32((4ALLYL5((4IODOANILINO)METHYL)4H124TRIAZOL3YL)SULFANYL)N(2NAPHTHYLMETHYLENE)PROPANOHYDRAZIDE
2((5(((4iodophenyl)amino)methyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)N((E)naphthalen2ylmethylidene)propanehydrazide
2((5((4iodoanilino)methyl)4prop2enyl124triazol3yl)sulfanyl)N((E)naphthalen2ylmethylideneamino)propanamide
570418303
C=CCn1c(nnc1CNc1ccc(cc1)I)SC(C(=O)NN=Cc1ccc2c(c1)cccc2)C
CC(C(=O)NN=CC1=CC2=CC=CC=C2C=C1)SC3=NN=C(N3CC=C)CNC4=CC=C(C=C4)I
InChI=1SC26H25IN6OSc13143324(172823121022(27)111323)303226(33)3518(2)25(34)312916198920645721(20)1519h31315161828H11417H22H3(H3134)b2916+
MFCD01437068
ZINC000002097828
ZINC000002097833
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