Vitas-M small molecule compound
2-(1,3-benzoxazol-2-ylsulfanyl)-1-[4-(4-phenylphthalazin-1-yl)piperazin-1-yl]ethanone
Catalog ID
STK126975
SMILES O=C(N1CCN(CC1)c1nnc(c2c1cccc2)c1ccccc1)CSc1nc2c(o1)cccc2
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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 C27H23N5O2S MW 481.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23N5O2S/c33-24(18-35-27-28-22-12-6-7-13-23(22)34-27)31-14-16-32(17-15-31)26-21-11-5-4-10-20(21)25(29-30-26)19-8-2-1-3-9-19/h1-13H,14-18H2InChIKey
QXMCVUTWYMSHAR-UHFFFAOYSA-NSynonyms
755004-83-22(13BENZOXAZOL2YLSULFANYL)1(4(4PHENYLPHTHALAZIN1YL)PIPERAZIN1YL)ETHANONE
2(benzo(d)oxazol2ylthio)1(4(4phenylphthalazin1yl)piperazin1yl)ethanone
755004832
C1CN(CCN1C2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4)C(=O)CSC5=NC6=CC=CC=C6O5
InChI=1SC27H23N5O2Sc3324(183527282212671323(22)3427)31141632(171531)262111541020(21)25(293026)198213919h113H1418H2
MFCD04172472
ZINC000002420799
ZINC02420799
ZINC2420799
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