Vitas-M small molecule compound
2-(2,3-dihydro-1H-inden-2-ylamino)-4,4-dimethyl-6-oxo-N-[4-(propan-2-yl)phenyl]cyclohex-1-ene-1-carbothioamide
Catalog ID
STK262246
SMILES CC(c1ccc(cc1)NC(=S)C1=C(NC2Cc3c(C2)cccc3)CC(CC1=O)(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 C27H32N2OS MW 432.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N2OS/c1-17(2)18-9-11-21(12-10-18)29-26(31)25-23(15-27(3,4)16-24(25)30)28-22-13-19-7-5-6-8-20(19)14-22/h5-12,17,22,28H,13-16H2,1-4H3,(H,29,31)InChIKey
AQRWNBILUSNHMJ-UHFFFAOYSA-NSynonyms
2(23dihydro1Hinden2ylamino)44dimethyl6oxoN(4(propan2yl)phenyl)cyclohex1ene1carbothioamide
2(23dihydro1Hinden2ylamino)44dimethyl6oxoN(4propan2ylphenyl)cyclohexene1carbothioamide
3(INDAN2YLAMINO)55DIMETHYL2(((4(METHYLETHYL)PHENYL)AMINO)THIOXOMETHYL)CYCLOHEX2EN1ONE
CC(C)C1=CC=C(C=C1)NC(=S)C2=C(CC(CC2=O)(C)C)NC3CC4=CC=CC=C4C3
InChI=1SC27H32N2OSc117(2)1891121(121018)2926(31)2523(1527(34)1624(25)30)28221319756820(19)1422h512172228H1316H214H3(H2931)
MFCD08087150
ZINC000019944005
ZINC19944005
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