Vitas-M small molecule compound
11,12-dihydroxy-4,8-bis(3-methylphenyl)-3,4,4a,5,6,7,7a,8-octahydrochromeno[3,2-i]quinazoline-2(1H)-thione
Catalog ID
STK687379
SMILES Cc1cccc(c1)C1NC(=S)NC23C1CCCC3C(c1c(O2)c(O)c(O)cc1)c1cccc(c1)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 C29H30N2O3S MW 486.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N2O3S/c1-16-6-3-8-18(14-16)24-20-12-13-23(32)26(33)27(20)34-29-21(24)10-5-11-22(29)25(30-28(35)31-29)19-9-4-7-17(2)15-19/h3-4,6-9,12-15,21-22,24-25,32-33H,5,10-11H2,1-2H3,(H2,30,31,35)InChIKey
MOKMXDVHASCMMM-UHFFFAOYSA-NSynonyms
1112dihydroxy48bis(3methylphenyl)344a5677a8octahydrochromeno(32i)quinazoline2(1H)thione
CC1=CC=CC(=C1)C2C3CCCC4C3(NC(=S)NC4C5=CC(=CC=C5)C)OC6=C2C=CC(=C6O)O
InChI=1SC29H30N2O3Sc11663818(1416)2420121323(32)26(33)27(20)342921(24)1051122(29)25(3028(35)3129)1994717(2)1519h34691215212224253233H51011H212H3(H2303135)
MFCD06618490
ZINC000033821798
ZINC000248091501
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