Vitas-M small molecule compound
4-methyl-N-[2-methyl-1-(4-methyl-5-{[2-(4-methylpiperazin-1-yl)-2-oxoethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)propyl]benzamide
Catalog ID
STL384120
SMILES CN1CCN(CC1)C(=O)CSc1nnc(n1C)C(C(C)C)NC(=O)c1ccc(cc1)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 C22H32N6O2S MW 444.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H32N6O2S/c1-15(2)19(23-21(30)17-8-6-16(3)7-9-17)20-24-25-22(27(20)5)31-14-18(29)28-12-10-26(4)11-13-28/h6-9,15,19H,10-14H2,1-5H3,(H,23,30)InChIKey
CIKJPHILSFGONF-UHFFFAOYSA-NSynonyms
4methylN(2methyl1(4methyl5((2(4methylpiperazin1yl)2oxoethyl)sulfanyl)4H124triazol3yl)propyl)benzamide
4METHYLN(2METHYL1(4METHYL5(2(4METHYLPIPERAZIN1YL)2OXOETHYL)SULFANYL124TRIAZOL3YL)PROPYL)BENZAMIDE
4METHYLN(2METHYL1(4METHYL5(2(4METHYLPIPERAZIN1YL)2OXOETHYLTHIO)4H124TRIAZOL3YL)PROPYL)BENZAMIDE
CC1=CC=C(C=C1)C(=O)NC(C2=NN=C(N2C)SCC(=O)N3CCN(CC3)C)C(C)C
InChI=1SC22H32N6O2Sc115(2)19(2321(30)178616(3)7917)20242522(27(20)5)311418(29)28121026(4)111328h691519H1014H215H3(H2330)
MFCD06124800
ZINC000025180742
ZINC000025180752
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