Vitas-M small molecule compound
3-{(2S)-1-[4-(3-chlorophenyl)piperazin-1-yl]-3-methyl-1-oxobutan-2-yl}-1,2,3-benzotriazin-4(3H)-one
Catalog ID
STK717220
SMILES Clc1cccc(c1)N1CCN(CC1)C(=O)[C@@H](n1nnc2c(c1=O)cccc2)C(C)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 C22H24ClN5O2 MW 425.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24ClN5O2/c1-15(2)20(28-21(29)18-8-3-4-9-19(18)24-25-28)22(30)27-12-10-26(11-13-27)17-7-5-6-16(23)14-17/h3-9,14-15,20H,10-13H2,1-2H3/t20-/m0/s1InChIKey
RBMYETIOIJHULE-FQEVSTJZSA-NSynonyms
1173685-54-5(S)3(1(4(3chlorophenyl)piperazin1yl)3methyl1oxobutan2yl)benzo(d)(123)triazin4(3H)one
1173685545
3((2S)1(4(3chlorophenyl)piperazin1yl)3methyl1oxobutan2yl)123benzotriazin4(3H)one
3((2S)1(4(3chlorophenyl)piperazin1yl)3methyl1oxobutan2yl)123benzotriazin4one
CC(C)C(C(=O)N1CCN(CC1)C2=CC(=CC=C2)Cl)N3C(=O)C4=CC=CC=C4N=N3
Clc1cccc(c1)N1CCN(CC1)C(=O)(C@@H)(n1nnc2c(c1=O)cccc2)C(C)C
InChI=1SC22H24ClN5O2c115(2)20(2821(29)18834919(18)242528)22(30)27121026(111327)1775616(23)1417h39141520H1013H212H3t20m0s1
MFCD06777988
ZINC000009487683
ZINC09487683
ZINC9487683
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