Vitas-M small molecule compound
4-phenyl-1-[(2-phenylethyl)sulfanyl]-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
Catalog ID
STK524313
SMILES O=c1n(c2ccccc2)c2nnc(n2c2c1C1(CCCCC1)Cc1c2cccc1)SCCc1ccccc1
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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 C32H30N4OS MW 518.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H30N4OS/c37-29-27-28(26-17-9-8-14-24(26)22-32(27)19-10-3-11-20-32)36-30(35(29)25-15-6-2-7-16-25)33-34-31(36)38-21-18-23-12-4-1-5-13-23/h1-2,4-9,12-17H,3,10-11,18-22H2InChIKey
RMLNAQVFQVEABG-UHFFFAOYSA-NSynonyms
374100-17-11(phenethylthio)4phenyl4Hspiro(benzo(h)(124)triazolo(43a)quinazoline61cyclohexan)5(7H)one
374100171
4phenyl1((2phenylethyl)sulfanyl)4Hspiro(benzo(h)(124)triazolo(43a)quinazoline61cyclohexan)5(7H)one
C1CCC2(CC1)CC3=CC=CC=C3C4=C2C(=O)N(C5=NN=C(N45)SCCC6=CC=CC=C6)C7=CC=CC=C7
InChI=1SC32H30N4OSc37292728(2617981424(26)2232(27)19103112032)3630(35(29)25156271625)333431(36)38211823124151323h12491217H310111822H2
MFCD01952954
ZINC000002286173
ZINC2286173
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