Vitas-M small molecule compound
8-cyclohexyl-N-phenyl-1,2,3a,4,5,6-hexahydro-3H-pyrazino[3,2,1-jk]carbazole-3-carbothioamide
Catalog ID
STK762084
SMILES S=C(N1CCn2c3C1CCCc3c1c2ccc(c1)C1CCCCC1)Nc1ccccc1
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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 C27H31N3S MW 429.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31N3S/c31-27(28-21-10-5-2-6-11-21)30-17-16-29-24-15-14-20(19-8-3-1-4-9-19)18-23(24)22-12-7-13-25(30)26(22)29/h2,5-6,10-11,14-15,18-19,25H,1,3-4,7-9,12-13,16-17H2,(H,28,31)InChIKey
BOPWUPRJDPCGLA-UHFFFAOYSA-NSynonyms
8CYCLOHEXYLNPHENYL123A456HEXAHYDRO3HPYRAZINO(321JK)CARBAZOLE3CARBOTHIOAMIDE
C1CCC(CC1)C2=CC3=C(C=C2)N4CCN(C5C4=C3CCC5)C(=S)NC6=CC=CC=C6
InChI=1SC27H31N3Sc3127(2821105261121)3017162924151420(198314919)1823(24)221271325(30)26(22)29h25610111415181925H1347912131617H2(H2831)
MFCD00756723
ZINC000000846755
ZINC000000846756
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