Vitas-M small molecule compound
1-(4-{4-[3-acetyl-5-(4-ethoxyphenyl)-1-phenyl-1,5-dihydro-4H-1,2,4-triazol-4-yl]phenyl}piperazin-1-yl)propan-1-one
Catalog ID
STK511075
SMILES CCOc1ccc(cc1)C1N(c2ccc(cc2)N2CCN(CC2)C(=O)CC)C(=NN1c1ccccc1)C(=O)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 C31H35N5O3 MW 525.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H35N5O3/c1-4-29(38)34-21-19-33(20-22-34)25-13-15-26(16-14-25)35-30(23(3)37)32-36(27-9-7-6-8-10-27)31(35)24-11-17-28(18-12-24)39-5-2/h6-18,31H,4-5,19-22H2,1-3H3InChIKey
AXYULQUCVGURIW-UHFFFAOYSA-NSynonyms
1(4(4(3acetyl5(4ethoxyphenyl)1phenyl15dihydro4H124triazol4yl)phenyl)piperazin1yl)propan1one
1(4(4(5ACETYL3(4ETHOXYPHENYL)2PHENYL3H124TRIAZOL4YL)PHENYL)PIPERAZIN1YL)PROPAN1ONE
CCC(=O)N1CCN(CC1)C2=CC=C(C=C2)N3C(N(N=C3C(=O)C)C4=CC=CC=C4)C5=CC=C(C=C5)OCC
InChI=1SC31H35N5O3c1429(38)34211933(202234)25131526(161425)3530(23(3)37)3236(2797681027)31(35)24111728(181224)3952h61831H451922H213H3
MFCD05134691
ZINC000016609794
ZINC000016609796
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