Vitas-M small molecule compound
4-methoxy-N-{2-methyl-1-[5-({2-[(4-methyl-3-nitrophenyl)amino]-2-oxoethyl}sulfanyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]propyl}benzamide
Catalog ID
STK218489
SMILES C=CCn1c(SCC(=O)Nc2ccc(c(c2)[N+](=O)[O-])C)nnc1C(C(C)C)NC(=O)c1ccc(cc1)OC
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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 C26H30N6O5S MW 538.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N6O5S/c1-6-13-31-24(23(16(2)3)28-25(34)18-8-11-20(37-5)12-9-18)29-30-26(31)38-15-22(33)27-19-10-7-17(4)21(14-19)32(35)36/h6-12,14,16,23H,1,13,15H2,2-5H3,(H,27,33)(H,28,34)InChIKey
WDZITWQRCLGHSC-UHFFFAOYSA-NSynonyms
4METHOXYN(2METHYL1(5((2((4METHYL3NITROPHENYL)AMINO)2OXOETHYL)SULFANYL)4(PROP2EN1YL)4H124TRIAZOL3YL)PROPYL)BENZAMIDE
4METHOXYN(2METHYL1(5(2(4METHYL3NITROANILINO)2OXOETHYL)SULFANYL4PROP2ENYL124TRIAZOL3YL)PROPYL)BENZAMIDE
C=CCn1c(SCC(=O)Nc2ccc(c(c2)(N+)(=O)(O))C)nnc1C(C(C)C)NC(=O)c1ccc(cc1)OC
CC1=C(C=C(C=C1)NC(=O)CSC2=NN=C(N2CC=C)C(C(C)C)NC(=O)C3=CC=C(C=C3)OC)(N+)(=O)(O)
InChI=1SC26H30N6O5Sc16133124(23(16(2)3)2825(34)1881120(375)12918)293026(31)381522(33)271910717(4)21(1419)32(35)36h612141623H11315H225H3(H2733)(H2834)
MFCD07357881
ZINC000059611997
ZINC000059611999
Check stock
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Check stock on Vitas-MAvailable files
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